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E3 ubiquitin-protein ligase RNF144B

E3 ubiquitin-protein ligase which accepts ubiquitin from E2 ubiquitin-conjugating enzymes UBE2L3 and UBE2L6 in the form of a thioester and then directly transfers the ubiquitin to targeted substrates such as LCMT2, thereby promoting their degradation. Induces apoptosis via a p53/TP53-dependent but caspase-independent mechanism. Plays a crucial role in maintaining the genomic stability by controlling the degradation of multiple proteins involved in mitotic progression and DNA damage. Regulates epithelial homeostasis by mediating degradation of CDKN1A and isoform 2 of TP63. Plays a regulatory role in innate immunity by negatively regulating IRF3 activation and IFN-beta production. Mechanistically, inhibits TBK1 phosphorylation and 'Lys-63'-linked polyubiquitination independently of its E3 ligase activity. Alternatively, promotes 'Lys-27' and 'Lys-33'-linked ubiquitination of IFIH1/MDA5, promoting selective autophagic degradation of IFIH1/MDA5 to inhibit antiviral response.

AlphaFold DB , UniProt , Accession A0A096NL67, Species PAPAN (Papio anubis, Olive baboon), Gene RNF144B, Length 303 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.5	Very low	35.3	Very low	249 Å²	249	148.4 Å²	148.4	100%	1.227	86%	0.855	S	S	*	*				0	121.1	0	-77	165.2	126	0	0	107.9
2	G	32.3	Very low	35.1	Very low	75 Å²	75	150.9 Å²	150.9	77%	0.773	86%	0.857	S	S	*	*			trans	73.3	100.5	173.8	0	0	0	0	0	115.7
3	S	31.4	Very low	35.2	Very low	126 Å²	126	148.5 Å²	148.5	88%	0.881	85%	0.848	S	S	*	*				65.7	126.9	59.2	-153.4	0	0	0	0	111.7
4	A	33.2	Very low	35.8	Very low	99 Å²	99	145.7 Å²	145.7	82%	0.818	85%	0.851	S	S	*	*			cis	-168.4	167.6	-0.9	0	0	0	0	0	107.9
5	G	31.8	Very low	35.9	Very low	83 Å²	83	147.7 Å²	147.7	86%	0.856	85%	0.849	S	S	*	*			trans	135.4	58.5	165.3	0	0	0	0	0	116.7
6	R	39.8	Very low	36.5	Very low	204 Å²	204	148.8 Å²	148.8	77%	0.77	85%	0.851	S	S	*	*			trans	-89.8	140	163.6	-127.8	-177.9	-163.3	-173.2	6.8	107.7	H8	R6-H8 PolarHBondContact NE-NE2 3.3Å
7	L	30.6	Very low	36.7	Very low	178 Å²	178	147.2 Å²	147.2	93%	0.932	85%	0.848	S	S	*	*			trans	-148.5	123.7	142.9	-103.8	153.7	0	0	0	109.4
8	H	36.7	Very low	37	Very low	129 Å²	129	143.9 Å²	143.9	60%	0.597	84%	0.841	S	S	*	*			trans	-79.4	148.1	-173.3	-88.1	-120.9	0	0	0	111.3	R6	R6-H8 PolarHBondContact NE-NE2 3.3Å
9	Y	40.5	Very low	37.9	Very low	234 Å²	234	143.7 Å²	143.7	92%	0.918	85%	0.845	S	S	*	*			trans	-63.9	137.1	160.2	-88.4	-97.8	0	0	0	110.3
10	L	33.9	Very low	38.8	Very low	158 Å²	158	139.7 Å²	139.7	83%	0.827	84%	0.835	S	S	*	*			trans	-143.6	117.4	154.9	-103	156.3	0	0	0	109.1
11	A	42.3	Very low	39.3	Very low	97 Å²	97	141 Å²	141	80%	0.802	84%	0.838	S	S	*	*			trans	-63.2	136.4	164.1	0	0	0	0	0	109.1
12	M	33.7	Very low	40.5	Very low	179 Å²	179	137.6 Å²	137.6	88%	0.882	82%	0.824	S	S	*	*			trans	-123.8	134.8	165.4	-64.8	-163.2	95.2	0	0	110
13	T	36	Very low	42.1	Very low	120 Å²	120	137.9 Å²	137.9	74%	0.736	82%	0.819	S	S	*	*			trans	-54.7	153.1	-170.8	40.7	0	0	0	0	115.6	E15	T13-E15 PolarHBondContact O-N 3.28Å
14	A	43.6	Very low	43.8	Very low	109 Å²	109	137.9 Å²	137.9	90%	0.901	82%	0.816	S	S	*	*			trans	-59.1	115.8	166.7	0	0	0	0	0	110.9
15	E	37.3	Very low	45.6	Very low	175 Å²	175	136.2 Å²	136.2	82%	0.818	80%	0.802	S	S	*	*			trans	-116.4	122.5	160.8	-65.9	-166.4	134.9	0	0	108	T13	T13-E15 PolarHBondContact O-N 3.28Å
16	N	45.6	Very low	48.2	Very low	165 Å²	165	136.8 Å²	136.8	88%	0.882	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-60.4	130.9	173.4	-89.3	-35.7	0	0	0	110
17	P	39.6	Very low	50.6	Low	122 Å²	122	131.8 Å²	131.8	79%	0.792	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-81.3	134.5	169.9	20.8	-10.3	0	0	0	111
18	A	41.9	Very low	53.7	Low	88 Å²	88	126.2 Å²	126.2	73%	0.727	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-65.2	156.3	172.7	0	0	0	0	0	112.2	G20	A18-G20 PolarHBondContact O-N 3.21Å
19	P	54.1	Low	56.5	Low	140 Å²	140	123.7 Å²	123.7	91%	0.909	74%	0.743	S	S	*	*	S	Bend	trans	-83.3	104.1	-179.4	32.5	-29.3	0	0	0	110
20	G	56.7	Low	59.2	Low	63 Å²	63	112.5 Å²	112.5	65%	0.649	70%	0.699	S	S	*	*			trans	177.6	126.6	173.5	0	0	0	0	0	111.4	A18	A18-G20 PolarHBondContact O-N 3.21Å
21	D	49	Very low	62.1	Low	167 Å²	167	110.9 Å²	110.9	89%	0.893	69%	0.685	S	S	*	*			trans	79.5	63.4	176.8	-56.2	-20.6	0	0	0	117.4	A23	D21-A23 VanDerWaalsContact C-N 3.35Å; D21-A23 PolarHBondContact O-N 3.07Å
22	L	59.5	Low	64.6	Low	178 Å²	178	109.6 Å²	109.6	93%	0.932	67%	0.665	S	S	*	*			trans	-70.3	94.3	152.7	-85.3	121.5	0	0	0	108.8
23	A	66.8	Low	67.6	Low	82 Å²	82	103.4 Å²	103.4	68%	0.678	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-53.1	132	159.5	0	0	0	0	0	108.4	D21 A25	D21-A23 VanDerWaalsContact C-N 3.35Å; D21-A23 PolarHBondContact O-N 3.07Å; A23-A25 PolarHBondContact O-N 3.06Å
24	P	66.8	Low	70.5	Confident	125 Å²	125	104 Å²	104	81%	0.812	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-55	128.1	177.4	-21.5	30.5	0	0	0	109.4
25	A	72.1	Confident	73	Confident	64 Å²	64	101.8 Å²	101.8	53%	0.529	61%	0.613	S	S	.	*	P	Polyproline II helix	trans	-55.4	136	175.9	0	0	0	0	0	109.3	A23 L27	A23-A25 PolarHBondContact O-N 3.06Å; A25-L27 PolarHBondContact O-N 3.31Å
26	P	84.7	Confident	75.8	Confident	95 Å²	95	99.5 Å²	99.5	62%	0.617	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-58.7	126.6	-179.1	21.4	-30.1	0	0	0	109.8	V39	P26-V39 HydrophobicContact CB-CG2 4.5Å; P26-V39 HydrophobicContact CG-CG2 4Å; P26-V39 WeakPolarHBondContact O-CG2 3.44Å
27	L	92.2	Very high	78.2	Confident	100 Å²	100	94 Å²	94	52%	0.524	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95	143.7	176.6	-61.9	177.6	0	0	0	109.7	A25 E36 Q37	A25-L27 PolarHBondContact O-N 3.31Å; L27-E36 HydrophobicContact CB-CB 4.29Å; L27-E36 HydrophobicContact CD1-CB 4.29Å; L27-Q37 WeakPolarHBondContact CA-O 3.34Å
28	I	94.8	Very high	80.8	Confident	60 Å²	60	89.2 Å²	89.2	31%	0.308	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	138.6	175.4	-55	175.2	0	0	0	107.5	E36 Q37 V39 M42	I28-E36 WeakPolarHBondContact O-CA 3.43Å; I28-Q37 PolarHBondContact N-O 2.84Å; I28-Q37 PolarHBondContact O-N 3.12Å; I28-V39 HydrophobicContact CD1-CG1 4.5Å; I28-V39 HydrophobicContact CD1-CG2 3.97Å; I28-V39 HydrophobicContact CG1-CG2 4.35Å; I28-M42 VanDerWaalsContact C-CE 3.45Å; I28-M42 HydrophobicContact CB-CE 3.51Å; I28-M42 HydrophobicContact CB-CG 4.32Å; I28-M42 HydrophobicContact CD1-CG 4.46Å; I28-M42 HydrophobicContact CG2-CE 3.61Å; I28-M42 WeakPolarHBondContact O-CE 3.01Å
29	T	96.3	Very high	83.2	Confident	76 Å²	76	88.7 Å²	88.7	47%	0.466	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	127.6	176	-45.5	0	0	0	0	110.8
30	C	96.9	Very high	85.1	Confident	0 Å²	0	88 Å²	88	0%	0	52%	0.517	C	S	.	.			trans	-79	130.8	173.9	177.4	0	0	0	0	111.1	L32 L34 C35 M42 C53	C30-L32 VanDerWaalsContact C-N 3.28Å; C30-L32 PolarHBondContact O-N 3.2Å; C30-L32 PolarHBondContact SG-N 2.54Å; C30-L32 VanDerWaalsContact SG-N 3.44Å; C30-L34 WeakPolarHBondContact O-CA 2.97Å; C30-L34 PolarHBondContact O-N 3.3Å; C30-C35 PolarHBondContact N-O 3.2Å; C30-M42 HydrophobicContact CB-CE 4.18Å; C30-C53 HydrophobicContact CB-CB 3.96Å; C30-C53 PolarHBondContact SG-N 2.8Å; C30-C53 VanDerWaalsContact SG-SG 3.66Å
31	K	94	Very high	86.9	Confident	124 Å²	124	90.3 Å²	90.3	54%	0.539	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-13.5	179.6	-64.3	177.2	173.6	-179.4	0	115.4	F52 D77	K31-F52 HydrophobicContact CB-CD1 4.3Å; K31-F52 HydrophobicContact CB-CE1 4.06Å; K31-D77 IonicContact NZ-OD2 2.68Å; K31-D77 PolarHBondContact NZ-OD2 3.5Å
32	L	95.8	Very high	89.2	Confident	70 Å²	70	83.4 Å²	83.4	37%	0.366	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-50.6	-179.2	-70.9	173	0	0	0	112.3	C30 F52 C56 P76	C30-L32 VanDerWaalsContact C-N 3.28Å; C30-L32 PolarHBondContact O-N 3.2Å; C30-L32 PolarHBondContact SG-N 2.54Å; C30-L32 VanDerWaalsContact SG-N 3.44Å; L32-F52 HydrophobicContact CD1-CB 4.43Å; L32-F52 HydrophobicContact CD1-CD1 3.79Å; L32-F52 HydrophobicContact CD1-CE1 4.3Å; L32-F52 HydrophobicContact CD1-CG 4.23Å; L32-F52 HydrophobicContact CG-CD1 3.69Å; L32-F52 HydrophobicContact CG-CE1 4Å; L32-C56 HydrophobicContact CB-CB 3.84Å; L32-C56 HydrophobicContact CD1-CB 3.74Å; L32-C56 HydrophobicContact CG-CB 4.45Å; L32-P76 HydrophobicContact CD1-CB 4.05Å; L32-P76 HydrophobicContact CD1-CG 4.22Å; L32-P76 HydrophobicContact CD2-CB 3.84Å; L32-P76 HydrophobicContact CG-CB 4.36Å
33	C	96.8	Very high	91	Very high	48 Å²	48	76.4 Å²	76.4	32%	0.324	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-8.8	177.9	61.4	0	0	0	0	114.3	C35 C56	C33-C35 PolarHBondContact O-N 3Å; C33-C35 VanDerWaalsContact O-N 3.14Å; C33-C35 PolarHBondContact O-SG 3.1Å; C33-C56 VanDerWaalsContact CB-SG 3.51Å; C33-C56 VanDerWaalsContact SG-SG 3.67Å
34	L	96.1	Very high	92.4	Very high	133 Å²	133	75.4 Å²	75.4	70%	0.696	42%	0.422	S	S	*	.			trans	61.7	14	-176.5	-49.3	179.1	0	0	0	114.4	C30	C30-L34 WeakPolarHBondContact O-CA 2.97Å; C30-L34 PolarHBondContact O-N 3.3Å
35	C	96.3	Very high	93.8	Very high	62 Å²	62	69.6 Å²	69.6	42%	0.419	38%	0.384	S	S	.	.			trans	-89.5	148.4	176	-53	0	0	0	0	111.8	C30 C33	C30-C35 PolarHBondContact N-O 3.2Å; C33-C35 PolarHBondContact O-N 3Å; C33-C35 VanDerWaalsContact O-N 3.14Å; C33-C35 PolarHBondContact O-SG 3.1Å
36	E	96.1	Very high	94.9	Very high	127 Å²	127	71.5 Å²	71.5	59%	0.593	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.3	134	168	-63.5	-172.2	148	0	0	110.5	L27 I28	L27-E36 HydrophobicContact CB-CB 4.29Å; L27-E36 HydrophobicContact CD1-CB 4.29Å; I28-E36 WeakPolarHBondContact O-CA 3.43Å
37	Q	95	Very high	95.4	Very high	51 Å²	51	71.6 Å²	71.6	24%	0.238	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	150.6	-179.6	-62.2	-71.3	5.9	0	0	109.8	L27 I28 K41 M42 C53	L27-Q37 WeakPolarHBondContact CA-O 3.34Å; I28-Q37 PolarHBondContact N-O 2.84Å; I28-Q37 PolarHBondContact O-N 3.12Å; Q37-K41 HydrophobicContact CB-CB 4.37Å; Q37-M42 HydrophobicContact CB-CE 3.98Å; Q37-M42 HydrophobicContact CB-SD 4.15Å; Q37-C53 HydrophobicContact CB-CB 4.49Å; Q37-C53 HydrophobicContact CG-CB 3.85Å
38	S	94.4	Very high	95.6	Very high	21 Å²	21	67.3 Å²	67.3	15%	0.147	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	153.4	171.6	57.3	0	0	0	0	111.1	D40 K41	S38-D40 WeakPolarHBondContact CB-OD1 3.48Å; S38-D40 PolarHBondContact O-N 2.86Å; S38-D40 PolarHBondContact OG-OD1 3.45Å; S38-K41 PolarHBondContact O-N 3.39Å
39	V	93.2	Very high	95.6	Very high	76 Å²	76	72.7 Å²	72.7	46%	0.461	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-58.3	-32.8	-175	-174.3	0	0	0	0	112.7	P26 I28 K41 M42	P26-V39 HydrophobicContact CB-CG2 4.5Å; P26-V39 HydrophobicContact CG-CG2 4Å; P26-V39 WeakPolarHBondContact O-CG2 3.44Å; I28-V39 HydrophobicContact CD1-CG1 4.5Å; I28-V39 HydrophobicContact CD1-CG2 3.97Å; I28-V39 HydrophobicContact CG1-CG2 4.35Å; V39-K41 PolarHBondContact O-N 3.34Å; V39-M42 WeakPolarHBondContact O-CB 3.31Å; V39-M42 PolarHBondContact O-N 2.86Å; V39-M42 VanDerWaalsContact O-N 3.1Å
40	D	93.8	Very high	95.6	Very high	126 Å²	126	69.9 Å²	69.9	67%	0.674	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-64.8	-23.5	177.1	59.8	-65.8	0	0	0	113.6	S38 M42	S38-D40 WeakPolarHBondContact CB-OD1 3.48Å; S38-D40 PolarHBondContact O-N 2.86Å; S38-D40 PolarHBondContact OG-OD1 3.45Å; D40-M42 VanDerWaalsContact C-N 3.34Å
41	K	95.2	Very high	95.5	Very high	111 Å²	111	73 Å²	73	48%	0.483	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-95	6.6	176.8	-63.1	179.3	-175.4	171.3	0	112.8	Q37 S38 V39 C53 T54	Q37-K41 HydrophobicContact CB-CB 4.37Å; S38-K41 PolarHBondContact O-N 3.39Å; V39-K41 PolarHBondContact O-N 3.34Å; K41-C53 CarbonylContact O-C 3.56Å; K41-C53 VanDerWaalsContact O-CA 3.31Å; K41-C53 WeakPolarHBondContact O-CA 3.5Å; K41-T54 PolarHBondContact O-N 3.35Å; K41-T54 PolarHBondContact O-OG1 3.43Å; K41-T54 VanDerWaalsContact O-OG1 3.12Å
42	M	96.6	Very high	95.7	Very high	22 Å²	22	67.1 Å²	67.1	11%	0.108	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	145.8	178.3	-66.9	-59.5	-148.9	0	0	111.1	I28 C30 Q37 V39 D40 I51 F52 C53	I28-M42 VanDerWaalsContact C-CE 3.45Å; I28-M42 HydrophobicContact CB-CE 3.51Å; I28-M42 HydrophobicContact CB-CG 4.32Å; I28-M42 HydrophobicContact CD1-CG 4.46Å; I28-M42 HydrophobicContact CG2-CE 3.61Å; I28-M42 WeakPolarHBondContact O-CE 3.01Å; C30-M42 HydrophobicContact CB-CE 4.18Å; Q37-M42 HydrophobicContact CB-CE 3.98Å; Q37-M42 HydrophobicContact CB-SD 4.15Å; V39-M42 WeakPolarHBondContact O-CB 3.31Å; V39-M42 PolarHBondContact O-N 2.86Å; V39-M42 VanDerWaalsContact O-N 3.1Å; D40-M42 VanDerWaalsContact C-N 3.34Å; M42-I51 HydrophobicContact CB-CG2 3.84Å; M42-I51 HydrophobicContact CG-CG2 4.24Å; M42-I51 HydrophobicContact SD-CG2 4.37Å; M42-F52 WeakPolarHBondContact CA-O 3.36Å; M42-C53 WeakPolarHBondContact SD-CA 3.42Å; M42-C53 HydrophobicContact SD-CB 3.78Å; M42-C53 PolarHBondContact SD-N 2.97Å
43	T	96.6	Very high	95.8	Very high	32 Å²	32	63.9 Å²	63.9	20%	0.196	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	131.3	174.7	-55.9	0	0	0	0	108.7	I51 F52 T54 L57 L94	T43-I51 WeakPolarHBondContact O-CA 3.48Å; T43-F52 PolarHBondContact N-O 3.11Å; T43-F52 PolarHBondContact O-N 3.28Å; T43-T54 PolarHBondContact OG1-OG1 3Å; T43-L57 HydrophobicContact CG2-CD2 3.88Å; T43-L94 HydrophobicContact CG2-CD1 4.31Å
44	T	96.1	Very high	95.8	Very high	60 Å²	60	63.1 Å²	63.1	37%	0.368	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	125.4	177.7	-57.5	0	0	0	0	108.8	R49 I51	T44-R49 HydrophobicContact CG2-CB 4.25Å; T44-I51 HydrophobicContact CG2-CG1 4.14Å
45	L	96.4	Very high	95.9	Very high	3 Å²	3	59.8 Å²	59.8	2%	0.016	31%	0.312	C	S	.	.			trans	-68.9	138.4	176.8	-64.9	-176.9	0	0	0	111.1	R49 C50 F52 L57 C75 L86 E90	L45-R49 WeakPolarHBondContact O-CA 3.19Å; L45-R49 PolarHBondContact O-N 3.03Å; L45-C50 HydrophobicContact CD1-CB 4.38Å; L45-C50 PolarHBondContact N-O 3.05Å; L45-F52 HydrophobicContact CD1-CD2 4.39Å; L45-F52 HydrophobicContact CD1-CE2 3.87Å; L45-F52 HydrophobicContact CG-CD2 4.49Å; L45-F52 HydrophobicContact CG-CE2 4.39Å; L45-L57 HydrophobicContact CD2-CD1 4.19Å; L45-L57 HydrophobicContact CD2-CD2 3.73Å; L45-C75 HydrophobicContact CD1-CB 4.18Å; L45-L86 HydrophobicContact CD1-CD1 3.87Å; L45-L86 HydrophobicContact CD2-CD1 4.12Å; L45-L86 HydrophobicContact CD2-CG 4Å; L45-E90 VanDerWaalsContact CA-OE1 3.3Å; L45-E90 WeakPolarHBondContact CA-OE1 3.41Å
46	Q	95.3	Very high	96	Very high	104 Å²	104	57.7 Å²	57.7	49%	0.486	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-47.9	-172.4	-66.7	-57.3	-38.5	0	0	113.5	R49 E90	Q46-R49 PolarHBondContact O-NE 3.21Å; Q46-R49 VanDerWaalsContact O-NE 3.15Å; Q46-E90 HydrophobicContact CG-CG 3.96Å; Q46-E90 WeakPolarHBondContact CG-OE1 3.3Å; Q46-E90 PolarHBondContact N-OE1 3.1Å
47	E	95.1	Very high	96	Very high	97 Å²	97	51.6 Å²	51.6	45%	0.453	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-45.7	-174.2	-67.9	-169.8	177.2	0	0	113	T85 Q87	E47-T85 PolarHBondContact OE2-N 2.85Å; E47-Q87 HydrophobicContact CG-CG 4.39Å
48	C	96.1	Very high	96.2	Very high	10 Å²	10	53.3 Å²	53.3	7%	0.068	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-9.6	-172.1	61.6	0	0	0	0	115.1	C50 C75 C80 N82	C48-C50 PolarHBondContact O-N 2.75Å; C48-C50 VanDerWaalsContact O-N 3.15Å; C48-C75 VanDerWaalsContact SG-SG 3.69Å; C48-C80 WeakPolarHBondContact CB-SG 3.34Å; C48-N82 HydrophobicContact CB-CB 3.77Å; C48-N82 PolarHBondContact O-ND2 2.94Å
49	R	95.6	Very high	96.3	Very high	174 Å²	174	58.4 Å²	58.4	66%	0.657	30%	0.297	S	S	*	.			trans	59.2	16.8	-176.7	-52.1	-56.9	-178.9	91.3	-1.2	115.1	T44 L45 Q46	T44-R49 HydrophobicContact CG2-CB 4.25Å; L45-R49 WeakPolarHBondContact O-CA 3.19Å; L45-R49 PolarHBondContact O-N 3.03Å; Q46-R49 PolarHBondContact O-NE 3.21Å; Q46-R49 VanDerWaalsContact O-NE 3.15Å
50	C	96.1	Very high	96.5	Very high	17 Å²	17	57.7 Å²	57.7	12%	0.115	29%	0.287	C	S	.	.			trans	-66.4	141.6	169.7	-65	0	0	0	0	110.2	L45 C48 F52 C80	L45-C50 HydrophobicContact CD1-CB 4.38Å; L45-C50 PolarHBondContact N-O 3.05Å; C48-C50 PolarHBondContact O-N 2.75Å; C48-C50 VanDerWaalsContact O-N 3.15Å; C50-F52 HydrophobicContact CB-CE2 3.59Å; C50-F52 HydrophobicContact CB-CZ 4.01Å; C50-C80 VanDerWaalsContact SG-SG 3.62Å
51	I	95.8	Very high	96.6	Very high	64 Å²	64	51.7 Å²	51.7	33%	0.328	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	131.1	-174.1	-52.1	-179.5	0	0	0	109.5	M42 T43 T44	M42-I51 HydrophobicContact CB-CG2 3.84Å; M42-I51 HydrophobicContact CG-CG2 4.24Å; M42-I51 HydrophobicContact SD-CG2 4.37Å; T43-I51 WeakPolarHBondContact O-CA 3.48Å; T44-I51 HydrophobicContact CG2-CG1 4.14Å
52	F	97.5	Very high	96.7	Very high	1 Å²	1	48.6 Å²	48.6	0%	0.004	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	159.4	175.9	-53.5	-86.4	0	0	0	110	K31 L32 M42 T43 L45 C50 L57 P76 D77	K31-F52 HydrophobicContact CB-CD1 4.3Å; K31-F52 HydrophobicContact CB-CE1 4.06Å; L32-F52 HydrophobicContact CD1-CB 4.43Å; L32-F52 HydrophobicContact CD1-CD1 3.79Å; L32-F52 HydrophobicContact CD1-CE1 4.3Å; L32-F52 HydrophobicContact CD1-CG 4.23Å; L32-F52 HydrophobicContact CG-CD1 3.69Å; L32-F52 HydrophobicContact CG-CE1 4Å; M42-F52 WeakPolarHBondContact CA-O 3.36Å; T43-F52 PolarHBondContact N-O 3.11Å; T43-F52 PolarHBondContact O-N 3.28Å; L45-F52 HydrophobicContact CD1-CD2 4.39Å; L45-F52 HydrophobicContact CD1-CE2 3.87Å; L45-F52 HydrophobicContact CG-CD2 4.49Å; L45-F52 HydrophobicContact CG-CE2 4.39Å; C50-F52 HydrophobicContact CB-CE2 3.59Å; C50-F52 HydrophobicContact CB-CZ 4.01Å; F52-L57 HydrophobicContact CD2-CD1 4.41Å; F52-P76 HydrophobicContact CE1-CB 4.18Å; F52-P76 HydrophobicContact CE1-CG 4.46Å; F52-P76 HydrophobicContact CE2-CG 4.09Å; F52-P76 HydrophobicContact CZ-CB 4Å; F52-P76 HydrophobicContact CZ-CG 4.02Å; F52-D77 HydrophobicContact CE1-CB 4.48Å; F52-D77 HydrophobicContact CZ-CB 3.9Å
53	C	97.9	Very high	96.6	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.02	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	142.3	171.4	76.3	0	0	0	0	109.5	C30 Q37 K41 M42 A55 C56 L57	C30-C53 HydrophobicContact CB-CB 3.96Å; C30-C53 PolarHBondContact SG-N 2.8Å; C30-C53 VanDerWaalsContact SG-SG 3.66Å; Q37-C53 HydrophobicContact CB-CB 4.49Å; Q37-C53 HydrophobicContact CG-CB 3.85Å; K41-C53 CarbonylContact O-C 3.56Å; K41-C53 VanDerWaalsContact O-CA 3.31Å; K41-C53 WeakPolarHBondContact O-CA 3.5Å; M42-C53 WeakPolarHBondContact SD-CA 3.42Å; M42-C53 HydrophobicContact SD-CB 3.78Å; M42-C53 PolarHBondContact SD-N 2.97Å; C53-A55 PolarHBondContact O-N 3.31Å; C53-C56 PolarHBondContact O-N 3.47Å; C53-C56 VanDerWaalsContact SG-CB 3.56Å; C53-C56 PolarHBondContact SG-N 3.11Å; C53-C56 PolarHBondContact SG-SG 3.22Å; C53-L57 PolarHBondContact O-N 3.48Å; C53-L57 VanDerWaalsContact O-N 3.11Å
54	T	97.4	Very high	96.5	Very high	32 Å²	32	51 Å²	51	20%	0.196	26%	0.257	C	S	.	.	H	α-helix	trans	-56.5	-39.8	-176.2	-53.2	0	0	0	0	111	K41 T43 C56 L57 K58 L94	K41-T54 PolarHBondContact O-N 3.35Å; K41-T54 PolarHBondContact O-OG1 3.43Å; K41-T54 VanDerWaalsContact O-OG1 3.12Å; T43-T54 PolarHBondContact OG1-OG1 3Å; T54-C56 PolarHBondContact O-N 3.46Å; T54-L57 PolarHBondContact O-N 3.21Å; T54-K58 HydrophobicContact CG2-CD 4.36Å; T54-K58 HydrophobicContact CG2-CG 4.39Å; T54-K58 VanDerWaalsContact O-CG 3.26Å; T54-K58 WeakPolarHBondContact O-CG 3.27Å; T54-K58 PolarHBondContact O-N 3.33Å; T54-L94 HydrophobicContact CG2-CD2 3.66Å
55	A	97.4	Very high	96.5	Very high	62 Å²	62	48.2 Å²	48.2	51%	0.512	24%	0.239	S	C	.	.	H	α-helix	trans	-59.4	-48.2	179.7	0	0	0	0	0	113	C53 K58 Q59	C53-A55 PolarHBondContact O-N 3.31Å; A55-K58 PolarHBondContact O-N 3.32Å; A55-Q59 WeakPolarHBondContact O-CG 3.26Å; A55-Q59 PolarHBondContact O-N 3.38Å
56	C	98	Very high	96.3	Very high	18 Å²	18	55.4 Å²	55.4	12%	0.122	27%	0.266	C	S	.	.	H	α-helix	trans	-66.2	-39.9	177.9	-73.2	0	0	0	0	111.8	L32 C33 C53 T54 K58 Q59 Y60	L32-C56 HydrophobicContact CB-CB 3.84Å; L32-C56 HydrophobicContact CD1-CB 3.74Å; L32-C56 HydrophobicContact CG-CB 4.45Å; C33-C56 VanDerWaalsContact CB-SG 3.51Å; C33-C56 VanDerWaalsContact SG-SG 3.67Å; C53-C56 PolarHBondContact O-N 3.47Å; C53-C56 VanDerWaalsContact SG-CB 3.56Å; C53-C56 PolarHBondContact SG-N 3.11Å; C53-C56 PolarHBondContact SG-SG 3.22Å; T54-C56 PolarHBondContact O-N 3.46Å; C56-K58 VanDerWaalsContact C-N 3.33Å; C56-K58 PolarHBondContact O-N 3.2Å; C56-Q59 PolarHBondContact O-N 3.44Å; C56-Y60 WeakPolarHBondContact O-CB 3.41Å; C56-Y60 PolarHBondContact O-N 2.9Å
57	L	97.3	Very high	96	Very high	0 Å²	0	57 Å²	57	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65.3	-39	-179.6	-166.2	61.9	0	0	0	111.7	T43 L45 F52 C53 T54 Y60 M61 P76 L86 L94	T43-L57 HydrophobicContact CG2-CD2 3.88Å; L45-L57 HydrophobicContact CD2-CD1 4.19Å; L45-L57 HydrophobicContact CD2-CD2 3.73Å; F52-L57 HydrophobicContact CD2-CD1 4.41Å; C53-L57 PolarHBondContact O-N 3.48Å; C53-L57 VanDerWaalsContact O-N 3.11Å; T54-L57 PolarHBondContact O-N 3.21Å; L57-Y60 HydrophobicContact CD1-CD1 4.41Å; L57-Y60 PolarHBondContact O-N 3.29Å; L57-M61 HydrophobicContact CG-CE 4.42Å; L57-M61 HydrophobicContact CG-SD 4.48Å; L57-M61 WeakPolarHBondContact O-CB 2.97Å; L57-M61 WeakPolarHBondContact O-CG 3.08Å; L57-M61 PolarHBondContact O-N 2.86Å; L57-P76 HydrophobicContact CD1-CG 4.03Å; L57-L86 HydrophobicContact CD1-CD2 4.39Å; L57-L94 HydrophobicContact CD2-CD1 3.56Å; L57-L94 HydrophobicContact CG-CD1 3.99Å
58	K	97.6	Very high	95.5	Very high	86 Å²	86	53.2 Å²	53.2	37%	0.374	26%	0.261	S	S	.	.	H	α-helix	trans	-58.8	-50	172.8	-71.3	-172.5	171.3	-178	0	112.2	T54 A55 C56 Y60 M61 Q62 L94	T54-K58 HydrophobicContact CG2-CD 4.36Å; T54-K58 HydrophobicContact CG2-CG 4.39Å; T54-K58 VanDerWaalsContact O-CG 3.26Å; T54-K58 WeakPolarHBondContact O-CG 3.27Å; T54-K58 PolarHBondContact O-N 3.33Å; A55-K58 PolarHBondContact O-N 3.32Å; C56-K58 VanDerWaalsContact C-N 3.33Å; C56-K58 PolarHBondContact O-N 3.2Å; K58-Y60 PolarHBondContact O-N 3.49Å; K58-M61 PolarHBondContact O-N 3.38Å; K58-Q62 VanDerWaalsContact O-CG 3.27Å; K58-Q62 WeakPolarHBondContact O-CG 3.3Å; K58-Q62 PolarHBondContact O-N 2.92Å; K58-L94 WeakPolarHBondContact CD-O 3.49Å; K58-L94 VanDerWaalsContact CE-O 3.3Å; K58-L94 WeakPolarHBondContact CE-O 3.31Å; K58-L94 HydrophobicContact CG-CB 4.1Å; K58-L94 HydrophobicContact CG-CD2 4.05Å; K58-L94 WeakPolarHBondContact CG-O 3.43Å
59	Q	97.4	Very high	95	Very high	128 Å²	128	55.8 Å²	55.8	60%	0.598	28%	0.278	S	S	*	.	H	α-helix	trans	-62.1	-44.2	179.2	-71.7	175.9	-10.8	0	0	111.6	A55 C56 Q62 L63	A55-Q59 WeakPolarHBondContact O-CG 3.26Å; A55-Q59 PolarHBondContact O-N 3.38Å; C56-Q59 PolarHBondContact O-N 3.44Å; Q59-Q62 PolarHBondContact O-N 3.17Å; Q59-L63 WeakPolarHBondContact O-CB 3.27Å; Q59-L63 PolarHBondContact O-N 2.83Å
60	Y	97.1	Very high	94.6	Very high	61 Å²	61	47.7 Å²	47.7	24%	0.239	25%	0.249	C	C	.	.	H	α-helix	trans	-58.1	-50.8	176.2	172.6	-99.5	0	0	0	111.8	C56 L57 K58 Q62 L63 A64 I73 T74 P76 L86	C56-Y60 WeakPolarHBondContact O-CB 3.41Å; C56-Y60 PolarHBondContact O-N 2.9Å; L57-Y60 HydrophobicContact CD1-CD1 4.41Å; L57-Y60 PolarHBondContact O-N 3.29Å; K58-Y60 PolarHBondContact O-N 3.49Å; Y60-Q62 PolarHBondContact O-N 3.23Å; Y60-L63 PolarHBondContact O-N 3.3Å; Y60-A64 WeakPolarHBondContact O-CB 3.48Å; Y60-A64 PolarHBondContact O-N 3.14Å; Y60-I73 HydrophobicContact CD1-CG2 4.37Å; Y60-I73 HydrophobicContact CE1-CG2 3.59Å; Y60-T74 WeakPolarHBondContact CE1-O 3.2Å; Y60-T74 PolarHBondContact OH-O 3.44Å; Y60-P76 HydrophobicContact CD1-CG 3.69Å; Y60-P76 HydrophobicContact CD2-CB 4.34Å; Y60-P76 HydrophobicContact CD2-CG 4.33Å; Y60-P76 HydrophobicContact CE1-CB 4.43Å; Y60-P76 HydrophobicContact CE1-CG 3.7Å; Y60-P76 HydrophobicContact CE2-CB 4.25Å; Y60-P76 HydrophobicContact CE2-CG 4.35Å; Y60-P76 HydrophobicContact CG-CB 4.48Å; Y60-P76 HydrophobicContact CG-CG 4Å; Y60-L86 HydrophobicContact CD1-CD2 4.47Å; Y60-L86 HydrophobicContact CE1-CD2 4.27Å
61	M	96.7	Very high	94.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-60.9	-44.3	178.9	-73.8	174.7	159	0	0	111.7	L57 K58 L63 A64 I65 L86 E90 I91 L94 V95	L57-M61 HydrophobicContact CG-CE 4.42Å; L57-M61 HydrophobicContact CG-SD 4.48Å; L57-M61 WeakPolarHBondContact O-CB 2.97Å; L57-M61 WeakPolarHBondContact O-CG 3.08Å; L57-M61 PolarHBondContact O-N 2.86Å; K58-M61 PolarHBondContact O-N 3.38Å; M61-L63 VanDerWaalsContact C-N 3.29Å; M61-L63 PolarHBondContact O-N 3.08Å; M61-A64 PolarHBondContact O-N 3.23Å; M61-I65 WeakPolarHBondContact O-CG1 3.48Å; M61-I65 PolarHBondContact O-N 3.32Å; M61-L86 HydrophobicContact CE-CB 4.08Å; M61-L86 HydrophobicContact CE-CD2 3.19Å; M61-L86 HydrophobicContact CE-CG 3.77Å; M61-L86 HydrophobicContact CG-CD2 3.68Å; M61-L86 HydrophobicContact SD-CD2 4.24Å; M61-E90 HydrophobicContact CE-CB 4.16Å; M61-I91 HydrophobicContact CE-CG1 3.98Å; M61-L94 HydrophobicContact CE-CB 4.46Å; M61-L94 HydrophobicContact CE-CD1 3.56Å; M61-L94 HydrophobicContact SD-CB 3.57Å; M61-L94 VanDerWaalsContact SD-CB 3.57Å; M61-L94 HydrophobicContact SD-CD1 3.6Å; M61-L94 HydrophobicContact SD-CG 4.23Å; M61-V95 HydrophobicContact CB-CG1 3.54Å; M61-V95 HydrophobicContact SD-CG1 4.2Å
62	Q	96.6	Very high	94.1	Very high	47 Å²	47	48.7 Å²	48.7	22%	0.22	26%	0.26	C	S	.	.	H	α-helix	trans	-61.8	-36.3	177.3	-72.7	174.6	-14.5	0	0	113.1	K58 Q59 Y60 R66 V95	K58-Q62 VanDerWaalsContact O-CG 3.27Å; K58-Q62 WeakPolarHBondContact O-CG 3.3Å; K58-Q62 PolarHBondContact O-N 2.92Å; Q59-Q62 PolarHBondContact O-N 3.17Å; Y60-Q62 PolarHBondContact O-N 3.23Å; Q62-R66 WeakPolarHBondContact O-CG 3.36Å; Q62-R66 PolarHBondContact O-N 3.37Å; Q62-R66 PolarHBondContact O-NE 3.45Å; Q62-V95 HydrophobicContact CG-CB 4.46Å; Q62-V95 HydrophobicContact CG-CG1 4.2Å
63	L	95.3	Very high	94	Very high	82 Å²	82	48.9 Å²	48.9	43%	0.429	26%	0.261	S	S	.	.	H	α-helix	trans	-69.6	-48.2	174.6	-174.8	65.4	0	0	0	110.7	Q59 Y60 M61 I65 R66 E67	Q59-L63 WeakPolarHBondContact O-CB 3.27Å; Q59-L63 PolarHBondContact O-N 2.83Å; Y60-L63 PolarHBondContact O-N 3.3Å; M61-L63 VanDerWaalsContact C-N 3.29Å; M61-L63 PolarHBondContact O-N 3.08Å; L63-I65 VanDerWaalsContact C-N 3.27Å; L63-I65 PolarHBondContact O-N 2.98Å; L63-R66 PolarHBondContact O-N 2.93Å; L63-R66 VanDerWaalsContact O-N 3.11Å; L63-E67 VanDerWaalsContact CD1-CD 3.5Å; L63-E67 HydrophobicContact CD1-CG 4.04Å; L63-E67 WeakPolarHBondContact CD1-OE1 3.5Å; L63-E67 PolarHBondContact O-N 3.42Å
64	A	94.4	Very high	93.9	Very high	22 Å²	22	52.2 Å²	52.2	18%	0.182	28%	0.282	C	S	.	.	H	α-helix	trans	-60	-35.6	179.2	0	0	0	0	0	112.6	Y60 M61 G68 I73	Y60-A64 WeakPolarHBondContact O-CB 3.48Å; Y60-A64 PolarHBondContact O-N 3.14Å; M61-A64 PolarHBondContact O-N 3.23Å; A64-G68 WeakPolarHBondContact O-CA 3.41Å; A64-G68 PolarHBondContact O-N 3.44Å; A64-I73 HydrophobicContact CB-CD1 4.18Å; A64-I73 HydrophobicContact CB-CG1 4.08Å; A64-I73 HydrophobicContact CB-CG2 3.79Å
65	I	95.4	Very high	93.8	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.01	28%	0.276	C	S	.	.	H	α-helix	trans	-66.4	-47.3	174.1	-67.9	167	0	0	0	110.9	M61 L63 I73 I91 V95 Q99 L102 Y103	M61-I65 WeakPolarHBondContact O-CG1 3.48Å; M61-I65 PolarHBondContact O-N 3.32Å; L63-I65 VanDerWaalsContact C-N 3.27Å; L63-I65 PolarHBondContact O-N 2.98Å; I65-I73 HydrophobicContact CD1-CD1 4.38Å; I65-I73 HydrophobicContact CG1-CD1 3.72Å; I65-I91 HydrophobicContact CD1-CG2 4Å; I65-V95 HydrophobicContact CD1-CB 4.4Å; I65-V95 HydrophobicContact CD1-CG1 4.01Å; I65-V95 HydrophobicContact CD1-CG2 4.01Å; I65-Q99 HydrophobicContact CD1-CB 4.46Å; I65-L102 HydrophobicContact CG2-CD2 4.16Å; I65-L102 HydrophobicContact CG2-CG 4.24Å; I65-Y103 HydrophobicContact CG1-CD2 4.02Å; I65-Y103 HydrophobicContact CG1-CG 4.23Å
66	R	92.3	Very high	93.8	Very high	153 Å²	153	49.4 Å²	49.4	58%	0.577	26%	0.259	S	S	*	.	H	α-helix	trans	-66.2	-39.8	-177.1	-80.2	-174.9	-78.7	-145.5	1.9	113	Q62 L63	Q62-R66 WeakPolarHBondContact O-CG 3.36Å; Q62-R66 PolarHBondContact O-N 3.37Å; Q62-R66 PolarHBondContact O-NE 3.45Å; L63-R66 PolarHBondContact O-N 2.93Å; L63-R66 VanDerWaalsContact O-N 3.11Å
67	E	88.4	Confident	93.6	Very high	138 Å²	138	49.7 Å²	49.7	65%	0.645	26%	0.259	S	S	*	.	H	α-helix	trans	-97.5	-23.6	-174.8	-61.3	-174.3	163.9	0	0	113.1	L63 C69	L63-E67 VanDerWaalsContact CD1-CD 3.5Å; L63-E67 HydrophobicContact CD1-CG 4.04Å; L63-E67 WeakPolarHBondContact CD1-OE1 3.5Å; L63-E67 PolarHBondContact O-N 3.42Å; E67-C69 VanDerWaalsContact C-N 3.31Å; E67-C69 PolarHBondContact O-N 3.47Å
68	G	84.9	Confident	93.1	Very high	18 Å²	18	58.5 Å²	58.5	19%	0.186	30%	0.302	C	S	.	.	S	Bend	trans	-78.7	-6.9	-168.6	0	0	0	0	0	115.3	A64 G70 S71	A64-G68 WeakPolarHBondContact O-CA 3.41Å; A64-G68 PolarHBondContact O-N 3.44Å; G68-G70 PolarHBondContact O-N 3.49Å; G68-G70 VanDerWaalsContact O-N 3.16Å; G68-S71 VanDerWaalsContact O-CB 3.26Å; G68-S71 WeakPolarHBondContact O-CB 3.33Å; G68-S71 PolarHBondContact O-N 3.31Å; G68-S71 PolarHBondContact O-OG 2.9Å
69	C	85.1	Confident	92.8	Very high	64 Å²	64	60 Å²	60	43%	0.432	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.6	41.3	178.5	-56.9	0	0	0	0	113.2	E67 S71 N213	E67-C69 VanDerWaalsContact C-N 3.31Å; E67-C69 PolarHBondContact O-N 3.47Å; C69-S71 VanDerWaalsContact C-N 3.31Å; C69-S71 PolarHBondContact O-N 2.92Å; C69-N213 PolarHBondContact O-OD1 2.92Å
70	G	89.1	Confident	92.6	Very high	4 Å²	4	54.1 Å²	54.1	4%	0.041	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	6.8	179.9	0	0	0	0	0	115.4	G68 R110	G68-G70 PolarHBondContact O-N 3.49Å; G68-G70 VanDerWaalsContact O-N 3.16Å; G70-R110 WeakPolarHBondContact O-CD 3.46Å
71	S	89	Confident	92.3	Very high	33 Å²	33	58.7 Å²	58.7	23%	0.231	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-64.4	152.4	171.5	59.2	0	0	0	0	112	G68 C69 I73	G68-S71 VanDerWaalsContact O-CB 3.26Å; G68-S71 WeakPolarHBondContact O-CB 3.33Å; G68-S71 PolarHBondContact O-N 3.31Å; G68-S71 PolarHBondContact O-OG 2.9Å; C69-S71 VanDerWaalsContact C-N 3.31Å; C69-S71 PolarHBondContact O-N 2.92Å; S71-I73 PolarHBondContact O-N 3Å
72	P	92	Very high	92.2	Very high	69 Å²	69	64 Å²	64	45%	0.448	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-58.1	133.6	174.3	-22.3	33	0	0	0	111	T74 T85	P72-T74 PolarHBondContact O-N 3.04Å; P72-T85 HydrophobicContact CB-CG2 3.76Å
73	I	95.1	Very high	91.9	Very high	5 Å²	5	69 Å²	69	3%	0.026	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-82	116.7	178	-53.5	178.4	0	0	0	107.6	Y60 A64 I65 S71 T85 L86 I91 Y103	Y60-I73 HydrophobicContact CD1-CG2 4.37Å; Y60-I73 HydrophobicContact CE1-CG2 3.59Å; A64-I73 HydrophobicContact CB-CD1 4.18Å; A64-I73 HydrophobicContact CB-CG1 4.08Å; A64-I73 HydrophobicContact CB-CG2 3.79Å; I65-I73 HydrophobicContact CD1-CD1 4.38Å; I65-I73 HydrophobicContact CG1-CD1 3.72Å; S71-I73 PolarHBondContact O-N 3Å; I73-T85 WeakPolarHBondContact O-CG2 3.36Å; I73-L86 HydrophobicContact CB-CB 4.24Å; I73-L86 HydrophobicContact CB-CD2 4.28Å; I73-L86 HydrophobicContact CG2-CB 4.41Å; I73-L86 HydrophobicContact CG2-CD2 3.54Å; I73-L86 HydrophobicContact CG2-CG 4.39Å; I73-L86 PolarHBondContact O-N 2.89Å; I73-I91 HydrophobicContact CD1-CD1 3.88Å; I73-I91 HydrophobicContact CD1-CG1 4.26Å; I73-I91 HydrophobicContact CG1-CD1 4.44Å; I73-Y103 HydrophobicContact CD1-CD2 4.32Å; I73-Y103 HydrophobicContact CD1-CE2 4.2Å; I73-Y103 HydrophobicContact CG1-CE2 4.1Å
74	T	95.1	Very high	91.8	Very high	73 Å²	73	65.1 Å²	65.1	45%	0.448	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-91.6	166.7	-178.2	58.2	0	0	0	0	112	Y60 P72 G84 L86	Y60-T74 WeakPolarHBondContact CE1-O 3.2Å; Y60-T74 PolarHBondContact OH-O 3.44Å; P72-T74 PolarHBondContact O-N 3.04Å; T74-G84 CarbonylContact C-O 3.6Å; T74-L86 WeakPolarHBondContact O-CD1 3.34Å
75	C	96.7	Very high	91.9	Very high	12 Å²	12	66.3 Å²	66.3	8%	0.081	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-53.8	135.2	172.8	-176.5	0	0	0	0	110.8	L45 C48 D77 C80 G84	L45-C75 HydrophobicContact CD1-CB 4.18Å; C48-C75 VanDerWaalsContact SG-SG 3.69Å; C75-D77 PolarHBondContact O-N 3.37Å; C75-D77 PolarHBondContact SG-N 3.39Å; C75-C80 HydrophobicContact CB-CB 4.2Å; C75-G84 WeakPolarHBondContact CB-O 3.49Å; C75-G84 PolarHBondContact N-O 3Å
76	P	95.8	Very high	91.9	Very high	22 Å²	22	66.5 Å²	66.5	14%	0.143	36%	0.357	C	S	.	.	S	Bend	trans	-67	-18.7	176.1	-17.2	27.4	0	0	0	114.5	L32 F52 L57 Y60 M78	L32-P76 HydrophobicContact CD1-CB 4.05Å; L32-P76 HydrophobicContact CD1-CG 4.22Å; L32-P76 HydrophobicContact CD2-CB 3.84Å; L32-P76 HydrophobicContact CG-CB 4.36Å; F52-P76 HydrophobicContact CE1-CB 4.18Å; F52-P76 HydrophobicContact CE1-CG 4.46Å; F52-P76 HydrophobicContact CE2-CG 4.09Å; F52-P76 HydrophobicContact CZ-CB 4Å; F52-P76 HydrophobicContact CZ-CG 4.02Å; L57-P76 HydrophobicContact CD1-CG 4.03Å; Y60-P76 HydrophobicContact CD1-CG 3.69Å; Y60-P76 HydrophobicContact CD2-CB 4.34Å; Y60-P76 HydrophobicContact CD2-CG 4.33Å; Y60-P76 HydrophobicContact CE1-CB 4.43Å; Y60-P76 HydrophobicContact CE1-CG 3.7Å; Y60-P76 HydrophobicContact CE2-CB 4.25Å; Y60-P76 HydrophobicContact CE2-CG 4.35Å; Y60-P76 HydrophobicContact CG-CB 4.48Å; Y60-P76 HydrophobicContact CG-CG 4Å; P76-M78 PolarHBondContact O-N 3.27Å
77	D	94.4	Very high	92	Very high	24 Å²	24	63.2 Å²	63.2	13%	0.128	35%	0.348	C	S	.	.			trans	-80.9	112.4	-179.4	-170.6	-14.3	0	0	0	110.4	K31 F52 C75 V79 C80	K31-D77 IonicContact NZ-OD2 2.68Å; K31-D77 PolarHBondContact NZ-OD2 3.5Å; F52-D77 HydrophobicContact CE1-CB 4.48Å; F52-D77 HydrophobicContact CZ-CB 3.9Å; C75-D77 PolarHBondContact O-N 3.37Å; C75-D77 PolarHBondContact SG-N 3.39Å; D77-V79 PolarHBondContact O-N 2.88Å; D77-V79 WeakPolarHBondContact OD1-CG2 3.48Å; D77-V79 PolarHBondContact OD1-N 2.93Å; D77-C80 HydrophobicContact CB-CB 4.15Å; D77-C80 WeakPolarHBondContact O-CB 3.47Å; D77-C80 PolarHBondContact O-N 3.4Å; D77-C80 VanDerWaalsContact O-N 3.07Å
78	M	87.5	Confident	92.4	Very high	185 Å²	185	60.3 Å²	60.3	91%	0.911	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-21.5	179.6	-62.7	-167.4	-59.2	0	0	113.6	P76	P76-M78 PolarHBondContact O-N 3.27Å
79	V	90.4	Very high	92.9	Very high	117 Å²	117	62.5 Å²	62.5	71%	0.709	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	20.9	175.9	-62	0	0	0	0	111.9	D77 L81	D77-V79 PolarHBondContact O-N 2.88Å; D77-V79 WeakPolarHBondContact OD1-CG2 3.48Å; D77-V79 PolarHBondContact OD1-N 2.93Å; V79-L81 PolarHBondContact O-N 3.23Å; V79-L81 VanDerWaalsContact O-N 3.09Å
80	C	93.6	Very high	93.4	Very high	5 Å²	5	60.3 Å²	60.3	3%	0.034	34%	0.335	C	S	.	.			trans	-62.6	109.2	174.3	-175.7	0	0	0	0	111	C48 C50 C75 D77 N82 H83	C48-C80 WeakPolarHBondContact CB-SG 3.34Å; C50-C80 VanDerWaalsContact SG-SG 3.62Å; C75-C80 HydrophobicContact CB-CB 4.2Å; D77-C80 HydrophobicContact CB-CB 4.15Å; D77-C80 WeakPolarHBondContact O-CB 3.47Å; D77-C80 PolarHBondContact O-N 3.4Å; D77-C80 VanDerWaalsContact O-N 3.07Å; C80-N82 PolarHBondContact O-N 3.31Å; C80-H83 PolarHBondContact O-N 3.42Å
81	L	91.3	Very high	93.8	Very high	158 Å²	158	60.1 Å²	60.1	83%	0.827	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-32	-179.9	-65	173.1	0	0	0	113.5	V79	V79-L81 PolarHBondContact O-N 3.23Å; V79-L81 VanDerWaalsContact O-N 3.09Å
82	N	93.3	Very high	94.1	Very high	112 Å²	112	60.6 Å²	60.6	60%	0.599	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-4.2	-176.4	-64.2	-36.3	0	0	0	113	C48 C80 G84	C48-N82 HydrophobicContact CB-CB 3.77Å; C48-N82 PolarHBondContact O-ND2 2.94Å; C80-N82 PolarHBondContact O-N 3.31Å; N82-G84 PolarHBondContact O-N 3.22Å
83	H	91.3	Very high	94.3	Very high	150 Å²	150	62.3 Å²	62.3	69%	0.694	35%	0.351	S	S	*	.			trans	45.2	39.8	-178	-59.3	-75.7	0	0	0	113.8	C80	C80-H83 PolarHBondContact O-N 3.42Å
84	G	93.3	Very high	94.3	Very high	1 Å²	1	63 Å²	63	1%	0.01	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-61.1	145.5	-169.2	0	0	0	0	0	112.9	T74 C75 N82	T74-G84 CarbonylContact C-O 3.6Å; C75-G84 WeakPolarHBondContact CB-O 3.49Å; C75-G84 PolarHBondContact N-O 3Å; N82-G84 PolarHBondContact O-N 3.22Å
85	T	95.6	Very high	94.4	Very high	48 Å²	48	60 Å²	60	29%	0.294	34%	0.336	S	S	.	.	B	Isolated β-bridge	trans	-102.2	145.4	170.6	-56.4	0	0	0	0	109	E47 P72 I73	E47-T85 PolarHBondContact OE2-N 2.85Å; P72-T85 HydrophobicContact CB-CG2 3.76Å; I73-T85 WeakPolarHBondContact O-CG2 3.36Å
86	L	95.8	Very high	94.4	Very high	6 Å²	6	62 Å²	62	3%	0.031	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-78.5	126.8	179	-80.4	54.3	0	0	0	108.7	L45 L57 Y60 M61 I73 T74 I91	L45-L86 HydrophobicContact CD1-CD1 3.87Å; L45-L86 HydrophobicContact CD2-CD1 4.12Å; L45-L86 HydrophobicContact CD2-CG 4Å; L57-L86 HydrophobicContact CD1-CD2 4.39Å; Y60-L86 HydrophobicContact CD1-CD2 4.47Å; Y60-L86 HydrophobicContact CE1-CD2 4.27Å; M61-L86 HydrophobicContact CE-CB 4.08Å; M61-L86 HydrophobicContact CE-CD2 3.19Å; M61-L86 HydrophobicContact CE-CG 3.77Å; M61-L86 HydrophobicContact CG-CD2 3.68Å; M61-L86 HydrophobicContact SD-CD2 4.24Å; I73-L86 HydrophobicContact CB-CB 4.24Å; I73-L86 HydrophobicContact CB-CD2 4.28Å; I73-L86 HydrophobicContact CG2-CB 4.41Å; I73-L86 HydrophobicContact CG2-CD2 3.54Å; I73-L86 HydrophobicContact CG2-CG 4.39Å; I73-L86 PolarHBondContact O-N 2.89Å; T74-L86 WeakPolarHBondContact O-CD1 3.34Å; L86-I91 HydrophobicContact CB-CD1 4.4Å; L86-I91 HydrophobicContact CB-CG1 4.19Å
87	Q	95.1	Very high	94.5	Very high	84 Å²	84	65.9 Å²	65.9	39%	0.393	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-76.1	153.4	-178.7	-61	-176	-3.4	0	0	111.4	E47 A89 E90 I91	E47-Q87 HydrophobicContact CG-CG 4.39Å; Q87-A89 PolarHBondContact O-N 3.4Å; Q87-E90 HydrophobicContact CB-CG 4.25Å; Q87-E90 PolarHBondContact N-OE2 2.9Å; Q87-E90 WeakPolarHBondContact O-CB 3.35Å; Q87-E90 PolarHBondContact O-N 3.24Å; Q87-I91 WeakPolarHBondContact O-CG1 3.31Å; Q87-I91 PolarHBondContact O-N 3.31Å
88	E	95.3	Very high	94.6	Very high	76 Å²	76	69.7 Å²	69.7	36%	0.355	39%	0.392	S	S	.	.	H	α-helix	trans	-56.3	-38.6	178.2	-76.5	-171.8	-161.5	0	0	113	E90 I91 A92 F100 Y103 K107	E88-E90 VanDerWaalsContact C-N 3.31Å; E88-E90 PolarHBondContact O-N 2.99Å; E88-I91 PolarHBondContact O-N 3.41Å; E88-A92 VanDerWaalsContact O-CB 3.27Å; E88-A92 WeakPolarHBondContact O-CB 3.41Å; E88-A92 PolarHBondContact O-N 2.95Å; E88-F100 HydrophobicContact CB-CE2 4.34Å; E88-F100 HydrophobicContact CB-CZ 4.43Å; E88-F100 WeakPolarHBondContact O-CE2 3.48Å; E88-Y103 HydrophobicContact CG-CE1 4.26Å; E88-K107 IonicContact OE1-NZ 2.72Å; E88-K107 PolarHBondContact OE1-NZ 2.86Å
89	A	95.9	Very high	95.1	Very high	65 Å²	65	61.7 Å²	61.7	54%	0.537	35%	0.353	S	S	.	.	H	α-helix	trans	-63.1	-37.4	176.6	0	0	0	0	0	112.1	Q87 C93	Q87-A89 PolarHBondContact O-N 3.4Å; A89-C93 WeakPolarHBondContact O-CB 3.38Å; A89-C93 PolarHBondContact O-N 3.5Å; A89-C93 VanDerWaalsContact O-N 3.17Å; A89-C93 PolarHBondContact O-SG 3.21Å
90	E	96	Very high	95.4	Very high	18 Å²	18	57.7 Å²	57.7	8%	0.084	33%	0.326	C	S	.	.	H	α-helix	trans	-68.6	-44	176.3	-63.8	176.5	107.6	0	0	110.7	L45 Q46 M61 Q87 E88 C93 L94	L45-E90 VanDerWaalsContact CA-OE1 3.3Å; L45-E90 WeakPolarHBondContact CA-OE1 3.41Å; Q46-E90 HydrophobicContact CG-CG 3.96Å; Q46-E90 WeakPolarHBondContact CG-OE1 3.3Å; Q46-E90 PolarHBondContact N-OE1 3.1Å; M61-E90 HydrophobicContact CE-CB 4.16Å; Q87-E90 HydrophobicContact CB-CG 4.25Å; Q87-E90 PolarHBondContact N-OE2 2.9Å; Q87-E90 WeakPolarHBondContact O-CB 3.35Å; Q87-E90 PolarHBondContact O-N 3.24Å; E88-E90 VanDerWaalsContact C-N 3.31Å; E88-E90 PolarHBondContact O-N 2.99Å; E90-C93 PolarHBondContact O-N 3.16Å; E90-L94 WeakPolarHBondContact O-CB 3.45Å; E90-L94 WeakPolarHBondContact O-CG 3.48Å; E90-L94 PolarHBondContact O-N 3Å
91	I	96.9	Very high	95.6	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-61.5	-51.2	178.3	-58.9	165.8	0	0	0	109.3	M61 I65 I73 L86 Q87 E88 C93 L94 V95 F100 Y103	M61-I91 HydrophobicContact CE-CG1 3.98Å; I65-I91 HydrophobicContact CD1-CG2 4Å; I73-I91 HydrophobicContact CD1-CD1 3.88Å; I73-I91 HydrophobicContact CD1-CG1 4.26Å; I73-I91 HydrophobicContact CG1-CD1 4.44Å; L86-I91 HydrophobicContact CB-CD1 4.4Å; L86-I91 HydrophobicContact CB-CG1 4.19Å; Q87-I91 WeakPolarHBondContact O-CG1 3.31Å; Q87-I91 PolarHBondContact O-N 3.31Å; E88-I91 PolarHBondContact O-N 3.41Å; I91-C93 PolarHBondContact O-N 3.01Å; I91-L94 PolarHBondContact O-N 3.15Å; I91-V95 HydrophobicContact CG2-CG1 4.3Å; I91-V95 HydrophobicContact CG2-CG2 3.9Å; I91-V95 WeakPolarHBondContact O-CG2 3.21Å; I91-V95 PolarHBondContact O-N 3.29Å; I91-F100 HydrophobicContact CB-CD2 4.32Å; I91-F100 HydrophobicContact CB-CE2 4.44Å; I91-F100 HydrophobicContact CG2-CD2 3.91Å; I91-F100 HydrophobicContact CG2-CE2 4.45Å; I91-Y103 HydrophobicContact CD1-CD1 4.2Å; I91-Y103 HydrophobicContact CD1-CE1 3.66Å; I91-Y103 HydrophobicContact CD1-CE2 4.43Å; I91-Y103 HydrophobicContact CG2-CD1 4.43Å
92	A	96.9	Very high	95.8	Very high	42 Å²	42	57.6 Å²	57.6	35%	0.347	32%	0.322	S	S	.	.	H	α-helix	trans	-56.9	-35.5	179.9	0	0	0	0	0	113.3	E88 F100	E88-A92 VanDerWaalsContact O-CB 3.27Å; E88-A92 WeakPolarHBondContact O-CB 3.41Å; E88-A92 PolarHBondContact O-N 2.95Å; A92-F100 HydrophobicContact CB-CD1 4.08Å; A92-F100 HydrophobicContact CB-CD2 3.93Å; A92-F100 HydrophobicContact CB-CE1 3.91Å; A92-F100 HydrophobicContact CB-CE2 3.77Å; A92-F100 HydrophobicContact CB-CG 4.08Å; A92-F100 HydrophobicContact CB-CZ 3.76Å
93	C	95.5	Very high	96	Very high	106 Å²	106	52.8 Å²	52.8	72%	0.716	30%	0.296	S	S	*	.	H	α-helix	trans	-75.1	-27.4	178	-69.8	0	0	0	0	113.5	A89 E90 I91	A89-C93 WeakPolarHBondContact O-CB 3.38Å; A89-C93 PolarHBondContact O-N 3.5Å; A89-C93 VanDerWaalsContact O-N 3.17Å; A89-C93 PolarHBondContact O-SG 3.21Å; E90-C93 PolarHBondContact O-N 3.16Å; I91-C93 PolarHBondContact O-N 3.01Å
94	L	95.4	Very high	96.2	Very high	18 Å²	18	49.5 Å²	49.5	9%	0.094	28%	0.281	C	S	.	.	H	α-helix	trans	-102	-32.1	-169.1	-72.2	172.7	0	0	0	113	T43 T54 L57 K58 M61 E90 I91	T43-L94 HydrophobicContact CG2-CD1 4.31Å; T54-L94 HydrophobicContact CG2-CD2 3.66Å; L57-L94 HydrophobicContact CD2-CD1 3.56Å; L57-L94 HydrophobicContact CG-CD1 3.99Å; K58-L94 WeakPolarHBondContact CD-O 3.49Å; K58-L94 VanDerWaalsContact CE-O 3.3Å; K58-L94 WeakPolarHBondContact CE-O 3.31Å; K58-L94 HydrophobicContact CG-CB 4.1Å; K58-L94 HydrophobicContact CG-CD2 4.05Å; K58-L94 WeakPolarHBondContact CG-O 3.43Å; M61-L94 HydrophobicContact CE-CB 4.46Å; M61-L94 HydrophobicContact CE-CD1 3.56Å; M61-L94 HydrophobicContact SD-CB 3.57Å; M61-L94 VanDerWaalsContact SD-CB 3.57Å; M61-L94 HydrophobicContact SD-CD1 3.6Å; M61-L94 HydrophobicContact SD-CG 4.23Å; E90-L94 WeakPolarHBondContact O-CB 3.45Å; E90-L94 WeakPolarHBondContact O-CG 3.48Å; E90-L94 PolarHBondContact O-N 3Å; I91-L94 PolarHBondContact O-N 3.15Å
95	V	96.9	Very high	96.2	Very high	10 Å²	10	56.9 Å²	56.9	6%	0.061	31%	0.308	C	S	.	.	S	Bend	trans	-99.6	154.1	-179.4	-49.8	0	0	0	0	112.1	M61 Q62 I65 I91 Q99 F100	M61-V95 HydrophobicContact CB-CG1 3.54Å; M61-V95 HydrophobicContact SD-CG1 4.2Å; Q62-V95 HydrophobicContact CG-CB 4.46Å; Q62-V95 HydrophobicContact CG-CG1 4.2Å; I65-V95 HydrophobicContact CD1-CB 4.4Å; I65-V95 HydrophobicContact CD1-CG1 4.01Å; I65-V95 HydrophobicContact CD1-CG2 4.01Å; I91-V95 HydrophobicContact CG2-CG1 4.3Å; I91-V95 HydrophobicContact CG2-CG2 3.9Å; I91-V95 WeakPolarHBondContact O-CG2 3.21Å; I91-V95 PolarHBondContact O-N 3.29Å; V95-Q99 HydrophobicContact CB-CB 4.15Å; V95-Q99 HydrophobicContact CG2-CB 4.02Å; V95-F100 HydrophobicContact CG2-CB 3.81Å
96	P	97.2	Very high	96.1	Very high	54 Å²	54	56.2 Å²	56.2	35%	0.351	30%	0.303	S	S	.	.			trans	-54.4	151.7	169.3	-28.9	38.4	0	0	0	113	D98 Q99 F100	P96-D98 VanDerWaalsContact C-N 3.29Å; P96-D98 WeakPolarHBondContact CB-OD1 3.16Å; P96-D98 PolarHBondContact O-N 2.91Å; P96-Q99 HydrophobicContact CB-CG 4.45Å; P96-Q99 WeakPolarHBondContact O-CB 3.4Å; P96-Q99 PolarHBondContact O-N 2.99Å; P96-F100 PolarHBondContact O-N 3.43Å
97	V	97.1	Very high	96	Very high	105 Å²	105	58.5 Å²	58.5	64%	0.636	31%	0.312	S	S	*	.	H	α-helix	trans	-58.2	-40.1	-174.7	179	0	0	0	0	112.3	Q99 F100 Q101	V97-Q99 PolarHBondContact O-N 3.46Å; V97-F100 PolarHBondContact O-N 3.19Å; V97-Q101 HydrophobicContact CG1-CG 4.44Å; V97-Q101 VanDerWaalsContact O-CG 3.3Å; V97-Q101 WeakPolarHBondContact O-CG 3.47Å; V97-Q101 PolarHBondContact O-N 2.93Å
98	D	97.1	Very high	95.9	Very high	103 Å²	103	58.8 Å²	58.8	55%	0.551	31%	0.313	S	S	*	.	H	α-helix	trans	-61.4	-41.6	176.2	58.7	-54.5	0	0	0	112.2	P96 Q101 L102	P96-D98 VanDerWaalsContact C-N 3.29Å; P96-D98 WeakPolarHBondContact CB-OD1 3.16Å; P96-D98 PolarHBondContact O-N 2.91Å; D98-Q101 PolarHBondContact O-N 2.82Å; D98-L102 WeakPolarHBondContact O-CB 3.3Å; D98-L102 PolarHBondContact O-N 2.85Å
99	Q	96.6	Very high	95.6	Very high	18 Å²	18	58.6 Å²	58.6	8%	0.084	31%	0.311	C	S	.	.	H	α-helix	trans	-69.7	-37.3	176.8	-70.3	-81.9	54.1	0	0	111.8	I65 V95 P96 V97 L102 Y103	I65-Q99 HydrophobicContact CD1-CB 4.46Å; V95-Q99 HydrophobicContact CB-CB 4.15Å; V95-Q99 HydrophobicContact CG2-CB 4.02Å; P96-Q99 HydrophobicContact CB-CG 4.45Å; P96-Q99 WeakPolarHBondContact O-CB 3.4Å; P96-Q99 PolarHBondContact O-N 2.99Å; V97-Q99 PolarHBondContact O-N 3.46Å; Q99-L102 PolarHBondContact O-N 2.86Å; Q99-Y103 PolarHBondContact O-N 3.4Å
100	F	97.5	Very high	95.2	Very high	32 Å²	32	57.2 Å²	57.2	14%	0.14	29%	0.292	C	S	.	.	H	α-helix	trans	-66.5	-43	174.9	-178.1	-115.6	0	0	0	111.6	E88 I91 A92 V95 P96 V97 L102 Y103 Q104	E88-F100 HydrophobicContact CB-CE2 4.34Å; E88-F100 HydrophobicContact CB-CZ 4.43Å; E88-F100 WeakPolarHBondContact O-CE2 3.48Å; I91-F100 HydrophobicContact CB-CD2 4.32Å; I91-F100 HydrophobicContact CB-CE2 4.44Å; I91-F100 HydrophobicContact CG2-CD2 3.91Å; I91-F100 HydrophobicContact CG2-CE2 4.45Å; A92-F100 HydrophobicContact CB-CD1 4.08Å; A92-F100 HydrophobicContact CB-CD2 3.93Å; A92-F100 HydrophobicContact CB-CE1 3.91Å; A92-F100 HydrophobicContact CB-CE2 3.77Å; A92-F100 HydrophobicContact CB-CG 4.08Å; A92-F100 HydrophobicContact CB-CZ 3.76Å; V95-F100 HydrophobicContact CG2-CB 3.81Å; P96-F100 PolarHBondContact O-N 3.43Å; V97-F100 PolarHBondContact O-N 3.19Å; F100-L102 VanDerWaalsContact C-N 3.32Å; F100-L102 PolarHBondContact O-N 3.15Å; F100-Y103 HydrophobicContact CD2-CD1 4.43Å; F100-Y103 HydrophobicContact CE2-CD1 4.39Å; F100-Y103 WeakPolarHBondContact O-CB 3.08Å; F100-Y103 PolarHBondContact O-N 3.3Å; F100-Q104 HydrophobicContact CD1-CG 4.48Å; F100-Q104 HydrophobicContact CE1-CG 4.09Å; F100-Q104 HydrophobicContact CE2-CG 4.21Å; F100-Q104 HydrophobicContact CZ-CG 3.94Å; F100-Q104 WeakPolarHBondContact O-CG 3.46Å; F100-Q104 PolarHBondContact O-N 2.93Å
101	Q	97.3	Very high	94.9	Very high	105 Å²	105	61 Å²	61	49%	0.491	31%	0.31	S	S	.	.	H	α-helix	trans	-61.8	-40.4	174.3	-73.1	174.3	-6.3	0	0	112	V97 D98 Q104 R105	V97-Q101 HydrophobicContact CG1-CG 4.44Å; V97-Q101 VanDerWaalsContact O-CG 3.3Å; V97-Q101 WeakPolarHBondContact O-CG 3.47Å; V97-Q101 PolarHBondContact O-N 2.93Å; D98-Q101 PolarHBondContact O-N 2.82Å; Q101-Q104 PolarHBondContact O-N 3.36Å; Q101-R105 WeakPolarHBondContact O-CB 3.17Å; Q101-R105 PolarHBondContact O-N 3.11Å
102	L	96	Very high	94.5	Very high	56 Å²	56	61 Å²	61	29%	0.293	31%	0.31	S	S	.	.	H	α-helix	trans	-60.5	-46.6	173	177.7	62.3	0	0	0	111.1	I65 D98 Q99 F100 Q104 R105 L106	I65-L102 HydrophobicContact CG2-CD2 4.16Å; I65-L102 HydrophobicContact CG2-CG 4.24Å; D98-L102 WeakPolarHBondContact O-CB 3.3Å; D98-L102 PolarHBondContact O-N 2.85Å; Q99-L102 PolarHBondContact O-N 2.86Å; F100-L102 VanDerWaalsContact C-N 3.32Å; F100-L102 PolarHBondContact O-N 3.15Å; L102-Q104 PolarHBondContact O-N 2.96Å; L102-R105 PolarHBondContact O-N 2.82Å; L102-L106 HydrophobicContact CD1-CD1 3.92Å; L102-L106 HydrophobicContact CD1-CG 3.99Å; L102-L106 HydrophobicContact CG-CD1 3.85Å; L102-L106 HydrophobicContact CG-CG 4.33Å; L102-L106 WeakPolarHBondContact O-CB 3.41Å; L102-L106 VanDerWaalsContact O-CG 3.31Å; L102-L106 WeakPolarHBondContact O-CG 3.12Å; L102-L106 PolarHBondContact O-N 3.49Å
103	Y	96.6	Very high	93.9	Very high	11 Å²	11	62.8 Å²	62.8	4%	0.043	31%	0.311	C	S	.	.	H	α-helix	trans	-57.4	-47.8	176.2	173.4	-107.3	0	0	0	112	I65 I73 E88 I91 Q99 F100 R105 L106 K107	I65-Y103 HydrophobicContact CG1-CD2 4.02Å; I65-Y103 HydrophobicContact CG1-CG 4.23Å; I73-Y103 HydrophobicContact CD1-CD2 4.32Å; I73-Y103 HydrophobicContact CD1-CE2 4.2Å; I73-Y103 HydrophobicContact CG1-CE2 4.1Å; E88-Y103 HydrophobicContact CG-CE1 4.26Å; I91-Y103 HydrophobicContact CD1-CD1 4.2Å; I91-Y103 HydrophobicContact CD1-CE1 3.66Å; I91-Y103 HydrophobicContact CD1-CE2 4.43Å; I91-Y103 HydrophobicContact CG2-CD1 4.43Å; Q99-Y103 PolarHBondContact O-N 3.4Å; F100-Y103 HydrophobicContact CD2-CD1 4.43Å; F100-Y103 HydrophobicContact CE2-CD1 4.39Å; F100-Y103 WeakPolarHBondContact O-CB 3.08Å; F100-Y103 PolarHBondContact O-N 3.3Å; Y103-R105 VanDerWaalsContact C-N 3.34Å; Y103-R105 PolarHBondContact O-N 3.3Å; Y103-L106 PolarHBondContact O-N 2.93Å; Y103-K107 HydrophobicContact CE1-CD 4.22Å; Y103-K107 WeakPolarHBondContact O-CB 3.4Å; Y103-K107 PolarHBondContact O-N 3.47Å
104	Q	96.3	Very high	93.3	Very high	81 Å²	81	61.3 Å²	61.3	38%	0.379	30%	0.296	S	S	.	.	H	α-helix	trans	-60.4	-43.5	178.5	-71	-178	-52.9	0	0	111.9	F100 Q101 L102 K107 F108	F100-Q104 HydrophobicContact CD1-CG 4.48Å; F100-Q104 HydrophobicContact CE1-CG 4.09Å; F100-Q104 HydrophobicContact CE2-CG 4.21Å; F100-Q104 HydrophobicContact CZ-CG 3.94Å; F100-Q104 WeakPolarHBondContact O-CG 3.46Å; F100-Q104 PolarHBondContact O-N 2.93Å; Q101-Q104 PolarHBondContact O-N 3.36Å; L102-Q104 PolarHBondContact O-N 2.96Å; Q104-K107 PolarHBondContact O-N 2.72Å; Q104-F108 WeakPolarHBondContact O-CB 2.99Å; Q104-F108 PolarHBondContact O-N 2.93Å
105	R	93.9	Very high	92.8	Very high	156 Å²	156	62.6 Å²	62.6	59%	0.589	30%	0.303	S	S	*	.	H	α-helix	trans	-61	-52.7	176	-174.7	-173.9	-56.4	172.6	3.4	111.5	Q101 L102 Y103 K107 F108 E109	Q101-R105 WeakPolarHBondContact O-CB 3.17Å; Q101-R105 PolarHBondContact O-N 3.11Å; L102-R105 PolarHBondContact O-N 2.82Å; Y103-R105 VanDerWaalsContact C-N 3.34Å; Y103-R105 PolarHBondContact O-N 3.3Å; R105-K107 VanDerWaalsContact C-N 3.31Å; R105-K107 PolarHBondContact O-N 2.96Å; R105-F108 PolarHBondContact O-N 3.26Å; R105-E109 WeakPolarHBondContact CG-OE1 3.35Å; R105-E109 WeakPolarHBondContact O-CG 3.39Å; R105-E109 PolarHBondContact O-N 3.43Å
106	L	92.6	Very high	92.2	Very high	34 Å²	34	65.9 Å²	65.9	18%	0.178	32%	0.324	C	S	.	.	H	α-helix	trans	-62.5	-38.8	-179.4	-68.3	172.9	0	0	0	111.8	L102 Y103 E109 R110	L102-L106 HydrophobicContact CD1-CD1 3.92Å; L102-L106 HydrophobicContact CD1-CG 3.99Å; L102-L106 HydrophobicContact CG-CD1 3.85Å; L102-L106 HydrophobicContact CG-CG 4.33Å; L102-L106 WeakPolarHBondContact O-CB 3.41Å; L102-L106 VanDerWaalsContact O-CG 3.31Å; L102-L106 WeakPolarHBondContact O-CG 3.12Å; L102-L106 PolarHBondContact O-N 3.49Å; Y103-L106 PolarHBondContact O-N 2.93Å; L106-E109 PolarHBondContact O-N 3.5Å; L106-R110 VanDerWaalsContact O-CB 3.32Å; L106-R110 WeakPolarHBondContact O-CB 3.29Å; L106-R110 PolarHBondContact O-N 3.41Å
107	K	93.7	Very high	91.7	Very high	55 Å²	55	69.7 Å²	69.7	24%	0.239	33%	0.332	C	S	.	.	H	α-helix	trans	-60.8	-48.6	174.9	177.7	-178.8	168.7	-179.7	0	110.7	E88 Y103 Q104 R105 R110 E111	E88-K107 IonicContact OE1-NZ 2.72Å; E88-K107 PolarHBondContact OE1-NZ 2.86Å; Y103-K107 HydrophobicContact CE1-CD 4.22Å; Y103-K107 WeakPolarHBondContact O-CB 3.4Å; Y103-K107 PolarHBondContact O-N 3.47Å; Q104-K107 PolarHBondContact O-N 2.72Å; R105-K107 VanDerWaalsContact C-N 3.31Å; R105-K107 PolarHBondContact O-N 2.96Å; K107-R110 WeakPolarHBondContact O-CB 3.44Å; K107-R110 PolarHBondContact O-N 2.96Å; K107-E111 WeakPolarHBondContact CE-OE1 3.44Å; K107-E111 WeakPolarHBondContact O-CG 3.27Å; K107-E111 PolarHBondContact O-N 3.23Å
108	F	93.1	Very high	91.4	Very high	90 Å²	90	70.5 Å²	70.5	40%	0.395	32%	0.324	S	S	.	.	H	α-helix	trans	-63	-44.6	177.3	-179.5	-108.6	0	0	0	112.1	Q104 R105 R110 E111 V112 W120 V129	Q104-F108 WeakPolarHBondContact O-CB 2.99Å; Q104-F108 PolarHBondContact O-N 2.93Å; R105-F108 PolarHBondContact O-N 3.26Å; F108-R110 VanDerWaalsContact C-N 3.29Å; F108-R110 PolarHBondContact O-N 3.42Å; F108-E111 PolarHBondContact O-N 3.49Å; F108-V112 HydrophobicContact CD1-CG2 4.38Å; F108-V112 HydrophobicContact CE1-CG2 3.99Å; F108-V112 HydrophobicContact CE2-CG2 4.13Å; F108-V112 HydrophobicContact CZ-CG2 3.85Å; F108-V112 WeakPolarHBondContact O-CG2 3.37Å; F108-V112 PolarHBondContact O-N 3.46Å; F108-W120 AromaticContact CD1-CH2 3.9Å; F108-W120 HydrophobicContact CD1-CH2 3.9Å; F108-W120 AromaticContact CD1-CZ2 3.97Å; F108-W120 HydrophobicContact CD1-CZ2 3.97Å; F108-W120 AromaticContact CE1-CH2 3.57Å; F108-W120 HydrophobicContact CE1-CH2 3.57Å; F108-W120 AromaticContact CE1-CZ2 3.86Å; F108-W120 HydrophobicContact CE1-CZ2 3.86Å; F108-V129 HydrophobicContact CE1-CG2 3.92Å; F108-V129 HydrophobicContact CZ-CG2 3.95Å
109	E	89.3	Confident	91	Very high	71 Å²	71	65.7 Å²	65.7	33%	0.332	30%	0.299	S	S	.	.	H	α-helix	trans	-55.7	-46.7	174.3	-75.9	174	-166.5	0	0	111.1	R105 L106 V112 H113 W120	R105-E109 WeakPolarHBondContact CG-OE1 3.35Å; R105-E109 WeakPolarHBondContact O-CG 3.39Å; R105-E109 PolarHBondContact O-N 3.43Å; L106-E109 PolarHBondContact O-N 3.5Å; E109-V112 PolarHBondContact O-N 2.87Å; E109-H113 PolarHBondContact O-N 2.91Å; E109-H113 PolarHBondContact O-ND1 3.36Å; E109-W120 HydrophobicContact CG-CZ2 3.96Å
110	R	87.6	Confident	90.8	Very high	37 Å²	37	67.4 Å²	67.4	14%	0.14	30%	0.304	C	S	.	.	H	α-helix	trans	-60.6	-46.4	176.1	179.1	-168.8	173	83.5	4.9	111.8	G70 L106 K107 F108 V112 H113 L114 N213	G70-R110 WeakPolarHBondContact O-CD 3.46Å; L106-R110 VanDerWaalsContact O-CB 3.32Å; L106-R110 WeakPolarHBondContact O-CB 3.29Å; L106-R110 PolarHBondContact O-N 3.41Å; K107-R110 WeakPolarHBondContact O-CB 3.44Å; K107-R110 PolarHBondContact O-N 2.96Å; F108-R110 VanDerWaalsContact C-N 3.29Å; F108-R110 PolarHBondContact O-N 3.42Å; R110-V112 VanDerWaalsContact C-N 3.31Å; R110-V112 PolarHBondContact O-N 3.22Å; R110-H113 PolarHBondContact O-N 3.11Å; R110-L114 HydrophobicContact CG-CD1 3.83Å; R110-L114 HydrophobicContact CG-CG 4.31Å; R110-L114 VanDerWaalsContact O-CG 3.31Å; R110-L114 WeakPolarHBondContact O-CG 3.32Å; R110-L114 PolarHBondContact O-N 3.02Å; R110-N213 VanDerWaalsContact CZ-O 3.3Å; R110-N213 VanDerWaalsContact NH1-C 3.26Å; R110-N213 PolarHBondContact NH1-O 2.86Å; R110-N213 PolarHBondContact NH1-OD1 2.61Å; R110-N213 PolarHBondContact NH2-O 2.99Å
111	E	89.6	Confident	90.6	Very high	97 Å²	97	66.4 Å²	66.4	45%	0.453	30%	0.301	S	S	.	.	H	α-helix	trans	-57.8	-44.7	178.6	-75	171	-178.1	0	0	111.4	K107 F108 H113 L114 D115	K107-E111 WeakPolarHBondContact CE-OE1 3.44Å; K107-E111 WeakPolarHBondContact O-CG 3.27Å; K107-E111 PolarHBondContact O-N 3.23Å; F108-E111 PolarHBondContact O-N 3.49Å; E111-H113 PolarHBondContact O-N 2.97Å; E111-L114 PolarHBondContact O-N 3.4Å; E111-D115 WeakPolarHBondContact O-CB 3.38Å; E111-D115 PolarHBondContact O-N 2.9Å
112	V	89.4	Confident	90.3	Very high	1 Å²	1	64 Å²	64	1%	0.006	30%	0.295	C	S	.	.	H	α-helix	trans	-63.8	-40	176.1	176.1	0	0	0	0	111.8	F108 E109 R110 L114 D115 R118 W120 V129	F108-V112 HydrophobicContact CD1-CG2 4.38Å; F108-V112 HydrophobicContact CE1-CG2 3.99Å; F108-V112 HydrophobicContact CE2-CG2 4.13Å; F108-V112 HydrophobicContact CZ-CG2 3.85Å; F108-V112 WeakPolarHBondContact O-CG2 3.37Å; F108-V112 PolarHBondContact O-N 3.46Å; E109-V112 PolarHBondContact O-N 2.87Å; R110-V112 VanDerWaalsContact C-N 3.31Å; R110-V112 PolarHBondContact O-N 3.22Å; V112-L114 VanDerWaalsContact C-N 3.31Å; V112-L114 PolarHBondContact O-N 3.48Å; V112-D115 PolarHBondContact O-N 2.8Å; V112-R118 HydrophobicContact CG1-CB 4.12Å; V112-W120 HydrophobicContact CB-CZ2 4.18Å; V112-W120 HydrophobicContact CG1-CD2 4.32Å; V112-W120 HydrophobicContact CG1-CG 4.26Å; V112-W120 HydrophobicContact CG1-CZ2 4.36Å; V112-W120 VanDerWaalsContact CG1-NE1 3.33Å; V112-W120 HydrophobicContact CG2-CZ2 4Å; V112-V129 HydrophobicContact CG1-CG1 3.83Å; V112-V129 HydrophobicContact CG1-CG2 4.21Å; V112-V129 HydrophobicContact CG2-CG1 4.06Å; V112-V129 HydrophobicContact CG2-CG2 3.85Å
113	H	83	Confident	90.2	Very high	79 Å²	79	64.2 Å²	64.2	37%	0.366	30%	0.298	S	S	.	.	H	α-helix	trans	-70	-25.8	178.4	-78.2	90.1	0	0	0	113.8	E109 R110 E111 W120 C196	E109-H113 PolarHBondContact O-N 2.91Å; E109-H113 PolarHBondContact O-ND1 3.36Å; R110-H113 PolarHBondContact O-N 3.11Å; E111-H113 PolarHBondContact O-N 2.97Å; H113-W120 AromaticContact CE1-CD1 3.55Å; H113-W120 AromaticContact CE1-NE1 3.58Å; H113-W120 AromaticContact ND1-CD1 3.98Å; H113-W120 AromaticContact ND1-NE1 3.71Å; H113-C196 HydrophobicContact CB-CB 4.46Å
114	L	83.3	Confident	89.8	Confident	75 Å²	75	67.5 Å²	67.5	39%	0.393	33%	0.328	S	S	.	.	H	α-helix	trans	-89.7	-20.3	178.9	-67	177	0	0	0	112.7	R110 E111 V112 P116 C214	R110-L114 HydrophobicContact CG-CD1 3.83Å; R110-L114 HydrophobicContact CG-CG 4.31Å; R110-L114 VanDerWaalsContact O-CG 3.31Å; R110-L114 WeakPolarHBondContact O-CG 3.32Å; R110-L114 PolarHBondContact O-N 3.02Å; E111-L114 PolarHBondContact O-N 3.4Å; V112-L114 VanDerWaalsContact C-N 3.31Å; V112-L114 PolarHBondContact O-N 3.48Å; L114-P116 WeakPolarHBondContact O-CD 3.17Å; L114-C214 HydrophobicContact CD2-CB 3.65Å
115	D	86.1	Confident	89.5	Confident	45 Å²	45	70.8 Å²	70.8	24%	0.241	35%	0.348	C	S	.	.			trans	-79.7	112.9	177.7	-173.2	-14.2	0	0	0	110.6	E111 V112 Y117 R118	E111-D115 WeakPolarHBondContact O-CB 3.38Å; E111-D115 PolarHBondContact O-N 2.9Å; V112-D115 PolarHBondContact O-N 2.8Å; D115-Y117 PolarHBondContact O-N 2.78Å; D115-Y117 VanDerWaalsContact O-N 3.1Å; D115-Y117 WeakPolarHBondContact OD1-CB 3.39Å; D115-Y117 WeakPolarHBondContact OD1-CD2 3.07Å; D115-Y117 PolarHBondContact OD1-N 3.39Å; D115-R118 HydrophobicContact CB-CB 4.17Å; D115-R118 HydrophobicContact CB-CG 4.24Å; D115-R118 PolarHBondContact O-N 2.93Å; D115-R118 WeakPolarHBondContact OD2-CD 3.29Å; D115-R118 WeakPolarHBondContact OD2-CG 3.48Å; D115-R118 IonicContact OD2-CZ 3.66Å; D115-R118 IonicContact OD2-NE 3.85Å; D115-R118 PolarHBondContact OD2-NE 3.16Å
116	P	83.3	Confident	89.5	Confident	79 Å²	79	64.7 Å²	64.7	51%	0.513	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-12	-179.6	29	-35.5	0	0	0	113.5	L114	L114-P116 WeakPolarHBondContact O-CD 3.17Å
117	Y	87.6	Confident	89.3	Confident	133 Å²	133	70.2 Å²	70.2	52%	0.522	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	6.1	-179.7	-54.7	-71.4	0	0	0	113.1	D115 P131 I132	D115-Y117 PolarHBondContact O-N 2.78Å; D115-Y117 VanDerWaalsContact O-N 3.1Å; D115-Y117 WeakPolarHBondContact OD1-CB 3.39Å; D115-Y117 WeakPolarHBondContact OD1-CD2 3.07Å; D115-Y117 PolarHBondContact OD1-N 3.39Å; Y117-P131 CarbonylContact O-C 3.52Å; Y117-P131 WeakPolarHBondContact O-CA 3.34Å; Y117-I132 PolarHBondContact O-N 3.33Å
118	R	89.9	Confident	89.3	Confident	122 Å²	122	68.8 Å²	68.8	46%	0.46	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	150.5	-179.4	-63	-179.2	-175.4	-165.4	-3.9	111.5	V112 D115 V129 C130	V112-R118 HydrophobicContact CG1-CB 4.12Å; D115-R118 HydrophobicContact CB-CB 4.17Å; D115-R118 HydrophobicContact CB-CG 4.24Å; D115-R118 PolarHBondContact O-N 2.93Å; D115-R118 WeakPolarHBondContact OD2-CD 3.29Å; D115-R118 WeakPolarHBondContact OD2-CG 3.48Å; D115-R118 IonicContact OD2-CZ 3.66Å; D115-R118 IonicContact OD2-NE 3.85Å; D115-R118 PolarHBondContact OD2-NE 3.16Å; R118-V129 HydrophobicContact CB-CG1 3.93Å; R118-V129 HydrophobicContact CG-CG1 4.25Å; R118-C130 WeakPolarHBondContact CA-O 3.44Å
119	T	89.6	Confident	89.4	Confident	3 Å²	3	66.5 Å²	66.5	2%	0.018	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	147.9	172	175.1	0	0	0	0	111.6	V129 C130 I132 V143 F152 K157	T119-V129 CarbonylContact O-C 3.59Å; T119-C130 HydrophobicContact CG2-CB 4.09Å; T119-C130 PolarHBondContact N-O 3.31Å; T119-C130 PolarHBondContact O-N 3.25Å; T119-I132 HydrophobicContact CG2-CD1 4.03Å; T119-I132 HydrophobicContact CG2-CG1 3.88Å; T119-V143 HydrophobicContact CG2-CG1 3.96Å; T119-V143 HydrophobicContact CG2-CG2 4.12Å; T119-F152 HydrophobicContact CG2-CE2 3.89Å; T119-F152 HydrophobicContact CG2-CZ 3.91Å; T119-K157 WeakPolarHBondContact OG1-CE 3.42Å; T119-K157 PolarHBondContact OG1-NZ 3.24Å
120	W	91.6	Very high	89.6	Confident	54 Å²	54	63.1 Å²	63.1	21%	0.205	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	143.4	165.1	-66.8	101.9	0	0	0	111.6	F108 E109 V112 H113 Q127 V129	F108-W120 AromaticContact CD1-CH2 3.9Å; F108-W120 HydrophobicContact CD1-CH2 3.9Å; F108-W120 AromaticContact CD1-CZ2 3.97Å; F108-W120 HydrophobicContact CD1-CZ2 3.97Å; F108-W120 AromaticContact CE1-CH2 3.57Å; F108-W120 HydrophobicContact CE1-CH2 3.57Å; F108-W120 AromaticContact CE1-CZ2 3.86Å; F108-W120 HydrophobicContact CE1-CZ2 3.86Å; E109-W120 HydrophobicContact CG-CZ2 3.96Å; V112-W120 HydrophobicContact CB-CZ2 4.18Å; V112-W120 HydrophobicContact CG1-CD2 4.32Å; V112-W120 HydrophobicContact CG1-CG 4.26Å; V112-W120 HydrophobicContact CG1-CZ2 4.36Å; V112-W120 VanDerWaalsContact CG1-NE1 3.33Å; V112-W120 HydrophobicContact CG2-CZ2 4Å; H113-W120 AromaticContact CE1-CD1 3.55Å; H113-W120 AromaticContact CE1-NE1 3.58Å; H113-W120 AromaticContact ND1-CD1 3.98Å; H113-W120 AromaticContact ND1-NE1 3.71Å; W120-Q127 HydrophobicContact CZ3-CB 4.39Å; W120-Q127 VanDerWaalsContact CZ3-O 3.23Å; W120-Q127 WeakPolarHBondContact CZ3-O 3.47Å; W120-V129 HydrophobicContact CD2-CG2 4.16Å; W120-V129 HydrophobicContact CE3-CG2 3.84Å; W120-V129 HydrophobicContact CH2-CG2 3.7Å; W120-V129 HydrophobicContact CZ2-CG2 3.97Å; W120-V129 HydrophobicContact CZ3-CG2 3.63Å
121	C	93	Very high	89.8	Confident	10 Å²	10	66 Å²	66	7%	0.068	35%	0.35	C	S	.	.			trans	-65.5	133	164.3	-177.9	0	0	0	0	109.6	V123 C126 T128 C145	C121-V123 VanDerWaalsContact C-N 3.29Å; C121-V123 PolarHBondContact O-N 3.4Å; C121-C126 HydrophobicContact CB-CB 4.27Å; C121-C126 VanDerWaalsContact SG-SG 3.62Å; C121-T128 WeakPolarHBondContact CB-O 3.4Å; C121-T128 PolarHBondContact N-O 3.31Å; C121-C145 HydrophobicContact CB-CB 4.47Å; C121-C145 VanDerWaalsContact SG-SG 3.7Å
122	P	92	Very high	89.8	Confident	55 Å²	55	62.7 Å²	62.7	36%	0.357	34%	0.336	S	S	.	.	S	Bend	trans	-76.5	-12.1	-179.4	27.3	-32.6	0	0	0	114.8	A124 L150 F152 K157	P122-A124 PolarHBondContact O-N 3.44Å; P122-L150 HydrophobicContact CG-CD2 3.73Å; P122-F152 HydrophobicContact CG-CB 4.16Å; P122-F152 HydrophobicContact CG-CD1 4.29Å; P122-F152 HydrophobicContact CG-CD2 4.01Å; P122-F152 HydrophobicContact CG-CE2 4.48Å; P122-F152 HydrophobicContact CG-CG 3.9Å; P122-K157 HydrophobicContact CB-CB 3.9Å; P122-K157 HydrophobicContact CG-CB 4.25Å; P122-K157 WeakPolarHBondContact CG-O 3.46Å
123	V	92.5	Very high	89.3	Confident	61 Å²	61	66.6 Å²	66.6	37%	0.37	37%	0.368	S	S	.	.	S	Bend	trans	-67.3	124.3	177.4	-176.5	0	0	0	0	108.7	C121 D125 C126 L150	C121-V123 VanDerWaalsContact C-N 3.29Å; C121-V123 PolarHBondContact O-N 3.4Å; V123-D125 PolarHBondContact O-N 2.76Å; V123-C126 HydrophobicContact CB-CB 3.89Å; V123-C126 HydrophobicContact CG1-CB 4.29Å; V123-C126 WeakPolarHBondContact O-CB 3.31Å; V123-C126 PolarHBondContact O-N 3.24Å; V123-L150 HydrophobicContact CG2-CB 4.14Å; V123-L150 HydrophobicContact CG2-CD2 3.4Å; V123-L150 VanDerWaalsContact CG2-CD2 3.4Å; V123-L150 HydrophobicContact CG2-CG 4.32Å
124	A	89.3	Confident	88.6	Confident	80 Å²	80	67 Å²	67	66%	0.661	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	140.8	171.9	0	0	0	0	0	110	P122 C126	P122-A124 PolarHBondContact O-N 3.44Å; A124-C126 PolarHBondContact O-N 2.68Å
125	D	89.4	Confident	87.2	Confident	150 Å²	150	67.6 Å²	67.6	80%	0.802	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.7	-9.3	-179.9	-50.4	-40.7	0	0	0	117.2	V123	V123-D125 PolarHBondContact O-N 2.76Å
126	C	93.3	Very high	86.1	Confident	27 Å²	27	71 Å²	71	18%	0.182	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-40.7	176	-178.1	0	0	0	0	112.3	C121 V123 A124 T128 C145	C121-C126 HydrophobicContact CB-CB 4.27Å; C121-C126 VanDerWaalsContact SG-SG 3.62Å; V123-C126 HydrophobicContact CB-CB 3.89Å; V123-C126 HydrophobicContact CG1-CB 4.29Å; V123-C126 WeakPolarHBondContact O-CB 3.31Å; V123-C126 PolarHBondContact O-N 3.24Å; A124-C126 PolarHBondContact O-N 2.68Å; C126-T128 PolarHBondContact O-N 3.09Å; C126-T128 PolarHBondContact O-OG1 3.18Å; C126-T128 PolarHBondContact SG-OG1 3.07Å; C126-T128 VanDerWaalsContact SG-OG1 3.34Å; C126-C145 VanDerWaalsContact SG-SG 3.66Å
127	Q	89.3	Confident	85	Confident	150 Å²	150	72.8 Å²	72.8	70%	0.701	42%	0.42	S	S	*	.			trans	46.3	28.7	177.1	-56.7	-176.5	17.8	0	0	114.4	W120	W120-Q127 HydrophobicContact CZ3-CB 4.39Å; W120-Q127 VanDerWaalsContact CZ3-O 3.23Å; W120-Q127 WeakPolarHBondContact CZ3-O 3.47Å
128	T	93.5	Very high	83.7	Confident	25 Å²	25	70 Å²	70	15%	0.153	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-93.9	128.3	-176.9	-62.8	0	0	0	0	109.8	C121 C126 P146 S147	C121-T128 WeakPolarHBondContact CB-O 3.4Å; C121-T128 PolarHBondContact N-O 3.31Å; C126-T128 PolarHBondContact O-N 3.09Å; C126-T128 PolarHBondContact O-OG1 3.18Å; C126-T128 PolarHBondContact SG-OG1 3.07Å; C126-T128 VanDerWaalsContact SG-OG1 3.34Å; T128-P146 HydrophobicContact CG2-CG 3.82Å; T128-S147 WeakPolarHBondContact CG2-OG 3.31Å; T128-S147 WeakPolarHBondContact OG1-CB 3.37Å; T128-S147 PolarHBondContact OG1-OG 3.43Å; T128-S147 VanDerWaalsContact OG1-OG 3.09Å
129	V	95	Very high	82.8	Confident	42 Å²	42	69.3 Å²	69.3	26%	0.255	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	119.2	171.8	-177.2	0	0	0	0	108.8	F108 V112 R118 T119 W120	F108-V129 HydrophobicContact CE1-CG2 3.92Å; F108-V129 HydrophobicContact CZ-CG2 3.95Å; V112-V129 HydrophobicContact CG1-CG1 3.83Å; V112-V129 HydrophobicContact CG1-CG2 4.21Å; V112-V129 HydrophobicContact CG2-CG1 4.06Å; V112-V129 HydrophobicContact CG2-CG2 3.85Å; R118-V129 HydrophobicContact CB-CG1 3.93Å; R118-V129 HydrophobicContact CG-CG1 4.25Å; T119-V129 CarbonylContact O-C 3.59Å; W120-V129 HydrophobicContact CD2-CG2 4.16Å; W120-V129 HydrophobicContact CE3-CG2 3.84Å; W120-V129 HydrophobicContact CH2-CG2 3.7Å; W120-V129 HydrophobicContact CZ2-CG2 3.97Å; W120-V129 HydrophobicContact CZ3-CG2 3.63Å
130	C	93.9	Very high	82.3	Confident	1 Å²	1	71.7 Å²	71.7	1%	0.007	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	137.6	-176.7	-51.7	0	0	0	0	110.1	R118 T119 V143 F152	R118-C130 WeakPolarHBondContact CA-O 3.44Å; T119-C130 HydrophobicContact CG2-CB 4.09Å; T119-C130 PolarHBondContact N-O 3.31Å; T119-C130 PolarHBondContact O-N 3.25Å; C130-V143 HydrophobicContact CB-CG1 3.48Å; C130-V143 VanDerWaalsContact CB-CG1 3.48Å; C130-F152 HydrophobicContact CB-CZ 4.35Å
131	P	92.1	Very high	82.2	Confident	96 Å²	96	70.5 Å²	70.5	62%	0.623	45%	0.447	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	147.3	174	31.3	-34	0	0	0	111.1	Y117	Y117-P131 CarbonylContact O-C 3.52Å; Y117-P131 WeakPolarHBondContact O-CA 3.34Å
132	I	88.5	Confident	82	Confident	29 Å²	29	73.5 Å²	73.5	15%	0.149	46%	0.462	C	S	.	.			trans	-107.3	116.2	174	-57.3	172.1	0	0	0	107.9	Y117 T119 V141 V143	Y117-I132 PolarHBondContact O-N 3.33Å; T119-I132 HydrophobicContact CG2-CD1 4.03Å; T119-I132 HydrophobicContact CG2-CG1 3.88Å; I132-V141 HydrophobicContact CG2-CB 4.15Å; I132-V141 HydrophobicContact CG2-CG1 4.31Å; I132-V141 HydrophobicContact CG2-CG2 4.4Å; I132-V143 HydrophobicContact CG1-CG2 4.16Å
133	A	79.8	Confident	82.1	Confident	82 Å²	82	71 Å²	71	68%	0.678	45%	0.446	S	S	*	.			trans	-74.4	123.3	174.7	0	0	0	0	0	109.5
134	S	68.3	Low	82.2	Confident	89 Å²	89	72.6 Å²	72.6	62%	0.622	45%	0.45	S	S	*	.			trans	-72.9	135.3	-166.2	57.4	0	0	0	0	115.5
135	S	53.1	Low	82.5	Confident	87 Å²	87	68.8 Å²	68.8	61%	0.608	42%	0.418	S	S	*	.	S	Bend	trans	-144.2	132.8	131.3	-74.7	0	0	0	0	106.7
136	D	62.8	Low	82.8	Confident	117 Å²	117	65.5 Å²	65.5	63%	0.626	41%	0.405	S	S	*	.	S	Bend	trans	32.5	124.6	-175.1	-74.3	-19	0	0	0	119.2	G138 Q139	D136-G138 PolarHBondContact O-N 2.87Å; D136-G138 VanDerWaalsContact O-N 3.12Å; D136-Q139 HydrophobicContact CB-CG 4.34Å; D136-Q139 PolarHBondContact O-N 3.1Å
137	P	60.1	Low	82.9	Confident	116 Å²	116	68 Å²	68	75%	0.753	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	121.6	176.8	-23.5	31.7	0	0	0	112.6
138	G	60	Low	83.2	Confident	73 Å²	73	63.3 Å²	63.3	75%	0.753	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.4	-2.3	174.7	0	0	0	0	0	116.1	D136	D136-G138 PolarHBondContact O-N 2.87Å; D136-G138 VanDerWaalsContact O-N 3.12Å
139	Q	72.7	Confident	83.2	Confident	109 Å²	109	68 Å²	68	51%	0.509	43%	0.426	S	S	.	.	S	Bend	trans	-78.6	144.2	169.6	-67	-162.7	19.4	0	0	111.8	D136 V141	D136-Q139 HydrophobicContact CB-CG 4.34Å; D136-Q139 PolarHBondContact O-N 3.1Å; Q139-V141 PolarHBondContact O-N 3.24Å
140	P	79.4	Confident	83.2	Confident	53 Å²	53	69.1 Å²	69.1	34%	0.344	43%	0.43	S	S	.	.			trans	-67.4	126.1	173.9	27.3	-32	0	0	0	110.3	C155	P140-C155 HydrophobicContact CB-CB 4.32Å
141	V	87.6	Confident	83.2	Confident	28 Å²	28	74.3 Å²	74.3	17%	0.17	45%	0.452	C	S	.	.			trans	-124.6	144	-179.1	179.5	0	0	0	0	109.4	I132 Q139 V143 S154 W160	I132-V141 HydrophobicContact CG2-CB 4.15Å; I132-V141 HydrophobicContact CG2-CG1 4.31Å; I132-V141 HydrophobicContact CG2-CG2 4.4Å; Q139-V141 PolarHBondContact O-N 3.24Å; V141-V143 PolarHBondContact O-N 3.09Å; V141-S154 PolarHBondContact N-OG 3.28Å; V141-S154 WeakPolarHBondContact O-CB 3.49Å; V141-S154 PolarHBondContact O-N 3.37Å; V141-S154 PolarHBondContact O-OG 3.01Å; V141-W160 WeakPolarHBondContact O-CZ3 3.31Å
142	L	90.4	Very high	83.2	Confident	74 Å²	74	69.8 Å²	69.8	39%	0.387	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	124	172.8	170.8	60.7	0	0	0	109.1	K151 W160	L142-K151 HydrophobicContact CD1-CB 3.85Å; L142-K151 HydrophobicContact CD1-CG 4.24Å; L142-W160 HydrophobicContact CB-CD2 3.55Å; L142-W160 HydrophobicContact CB-CE3 3.75Å; L142-W160 HydrophobicContact CB-CG 4.05Å; L142-W160 HydrophobicContact CB-CH2 4.16Å; L142-W160 HydrophobicContact CB-CZ2 3.98Å; L142-W160 HydrophobicContact CB-CZ3 4.08Å; L142-W160 HydrophobicContact CD1-CB 3.48Å; L142-W160 VanDerWaalsContact CD1-CB 3.48Å; L142-W160 HydrophobicContact CD1-CD2 3.9Å; L142-W160 HydrophobicContact CD1-CE3 4.43Å; L142-W160 HydrophobicContact CD1-CG 3.46Å; L142-W160 VanDerWaalsContact CD1-CG 3.46Å; L142-W160 HydrophobicContact CG-CD2 4.22Å; L142-W160 HydrophobicContact CG-CG 4.19Å
143	V	92.7	Very high	83.3	Confident	3 Å²	3	68.4 Å²	68.4	2%	0.018	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	131.4	173.7	-176.2	0	0	0	0	108.7	T119 C130 I132 V141 K151 F152	T119-V143 HydrophobicContact CG2-CG1 3.96Å; T119-V143 HydrophobicContact CG2-CG2 4.12Å; C130-V143 HydrophobicContact CB-CG1 3.48Å; C130-V143 VanDerWaalsContact CB-CG1 3.48Å; I132-V143 HydrophobicContact CG1-CG2 4.16Å; V141-V143 PolarHBondContact O-N 3.09Å; V143-K151 CarbonylContact O-C 3.6Å; V143-K151 WeakPolarHBondContact O-CA 3.36Å; V143-F152 HydrophobicContact CB-CD1 4.36Å; V143-F152 HydrophobicContact CB-CD2 4.39Å; V143-F152 HydrophobicContact CB-CE1 3.96Å; V143-F152 HydrophobicContact CB-CE2 4Å; V143-F152 HydrophobicContact CB-CZ 3.78Å; V143-F152 HydrophobicContact CG1-CE1 3.7Å; V143-F152 HydrophobicContact CG1-CE2 4.14Å; V143-F152 HydrophobicContact CG1-CZ 3.47Å; V143-F152 VanDerWaalsContact CG1-CZ 3.47Å; V143-F152 PolarHBondContact N-O 3.26Å; V143-F152 WeakPolarHBondContact O-CD1 3.45Å; V143-F152 PolarHBondContact O-N 3.5Å
144	E	95.2	Very high	83.6	Confident	94 Å²	94	65.2 Å²	65.2	44%	0.439	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	124.3	170.4	-173.4	173.3	156.2	0	0	109.2	H149 L150 K151	E144-H149 IonicContact OE1-ND1 2.61Å; E144-L150 WeakPolarHBondContact CA-O 3.44Å; E144-K151 HydrophobicContact CB-CG 4.24Å; E144-K151 HydrophobicContact CG-CG 4.08Å; E144-K151 WeakPolarHBondContact OE2-CE 3.23Å; E144-K151 IonicContact OE2-NZ 2.77Å
145	C	95.5	Very high	84.2	Confident	0 Å²	0	63 Å²	63	0%	0	37%	0.372	C	S	.	.			trans	-71.9	126.5	177.3	-179	0	0	0	0	110.6	C121 C126 S147 C148 H149 L150 F152	C121-C145 HydrophobicContact CB-CB 4.47Å; C121-C145 VanDerWaalsContact SG-SG 3.7Å; C126-C145 VanDerWaalsContact SG-SG 3.66Å; C145-S147 PolarHBondContact O-N 2.9Å; C145-C148 VanDerWaalsContact CB-SG 3.59Å; C145-C148 PolarHBondContact SG-SG 3.43Å; C145-H149 WeakPolarHBondContact O-CA 3.39Å; C145-H149 PolarHBondContact O-N 3.34Å; C145-L150 PolarHBondContact N-O 3.18Å; C145-F152 HydrophobicContact CB-CE1 4.31Å
146	P	95.5	Very high	85.6	Confident	80 Å²	80	60 Å²	60	52%	0.519	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-18.5	-179	27.7	-34.4	0	0	0	113.7	T128	T128-P146 HydrophobicContact CG2-CG 3.82Å
147	S	95.7	Very high	86.8	Confident	79 Å²	79	58 Å²	58	55%	0.552	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-40.8	-175.2	-59.6	0	0	0	0	113.5	T128 C145	T128-S147 WeakPolarHBondContact CG2-OG 3.31Å; T128-S147 WeakPolarHBondContact OG1-CB 3.37Å; T128-S147 PolarHBondContact OG1-OG 3.43Å; T128-S147 VanDerWaalsContact OG1-OG 3.09Å; C145-S147 PolarHBondContact O-N 2.9Å
148	C	95.3	Very high	88.1	Confident	52 Å²	52	57 Å²	57	35%	0.351	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	-0.5	-178.8	70.8	0	0	0	0	113.9	C145 L150	C145-C148 VanDerWaalsContact CB-SG 3.59Å; C145-C148 PolarHBondContact SG-SG 3.43Å; C148-L150 PolarHBondContact O-N 2.98Å
149	H	94.6	Very high	89.4	Confident	124 Å²	124	57.2 Å²	57.2	57%	0.574	32%	0.32	S	S	*	.			trans	57.9	13.1	-179.9	-57.1	-68.8	0	0	0	115.6	E144 C145 K151	E144-H149 IonicContact OE1-ND1 2.61Å; C145-H149 WeakPolarHBondContact O-CA 3.39Å; C145-H149 PolarHBondContact O-N 3.34Å; H149-K151 PolarHBondContact O-N 3.39Å
150	L	94.5	Very high	90.2	Very high	65 Å²	65	56.7 Å²	56.7	34%	0.34	31%	0.313	S	S	.	.			trans	-63.1	131.7	172.8	-178.9	68.8	0	0	0	110.1	P122 V123 E144 C145 C148 F152	P122-L150 HydrophobicContact CG-CD2 3.73Å; V123-L150 HydrophobicContact CG2-CB 4.14Å; V123-L150 HydrophobicContact CG2-CD2 3.4Å; V123-L150 VanDerWaalsContact CG2-CD2 3.4Å; V123-L150 HydrophobicContact CG2-CG 4.32Å; E144-L150 WeakPolarHBondContact CA-O 3.44Å; C145-L150 PolarHBondContact N-O 3.18Å; C148-L150 PolarHBondContact O-N 2.98Å; L150-F152 HydrophobicContact CD2-CB 4.4Å; L150-F152 HydrophobicContact CD2-CD1 4.36Å; L150-F152 HydrophobicContact CG-CD1 4.34Å
151	K	94.4	Very high	90.5	Very high	111 Å²	111	56.1 Å²	56.1	48%	0.483	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	117.4	172.2	-71.1	-179.5	-179.8	-179.2	0	110.3	L142 V143 E144 H149	L142-K151 HydrophobicContact CD1-CB 3.85Å; L142-K151 HydrophobicContact CD1-CG 4.24Å; V143-K151 CarbonylContact O-C 3.6Å; V143-K151 WeakPolarHBondContact O-CA 3.36Å; E144-K151 HydrophobicContact CB-CG 4.24Å; E144-K151 HydrophobicContact CG-CG 4.08Å; E144-K151 WeakPolarHBondContact OE2-CE 3.23Å; E144-K151 IonicContact OE2-NZ 2.77Å; H149-K151 PolarHBondContact O-N 3.39Å
152	F	92.2	Very high	89.8	Confident	1 Å²	1	58.7 Å²	58.7	0%	0.004	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	164.1	-173.6	65.4	-82	0	0	0	112.3	T119 P122 C130 V143 C145 L150 K157 D158	T119-F152 HydrophobicContact CG2-CE2 3.89Å; T119-F152 HydrophobicContact CG2-CZ 3.91Å; P122-F152 HydrophobicContact CG-CB 4.16Å; P122-F152 HydrophobicContact CG-CD1 4.29Å; P122-F152 HydrophobicContact CG-CD2 4.01Å; P122-F152 HydrophobicContact CG-CE2 4.48Å; P122-F152 HydrophobicContact CG-CG 3.9Å; C130-F152 HydrophobicContact CB-CZ 4.35Å; V143-F152 HydrophobicContact CB-CD1 4.36Å; V143-F152 HydrophobicContact CB-CD2 4.39Å; V143-F152 HydrophobicContact CB-CE1 3.96Å; V143-F152 HydrophobicContact CB-CE2 4Å; V143-F152 HydrophobicContact CB-CZ 3.78Å; V143-F152 HydrophobicContact CG1-CE1 3.7Å; V143-F152 HydrophobicContact CG1-CE2 4.14Å; V143-F152 HydrophobicContact CG1-CZ 3.47Å; V143-F152 VanDerWaalsContact CG1-CZ 3.47Å; V143-F152 PolarHBondContact N-O 3.26Å; V143-F152 WeakPolarHBondContact O-CD1 3.45Å; V143-F152 PolarHBondContact O-N 3.5Å; C145-F152 HydrophobicContact CB-CE1 4.31Å; L150-F152 HydrophobicContact CD2-CB 4.4Å; L150-F152 HydrophobicContact CD2-CD1 4.36Å; L150-F152 HydrophobicContact CG-CD1 4.34Å; F152-K157 HydrophobicContact CD2-CD 4.33Å; F152-K157 HydrophobicContact CE2-CD 4.24Å; F152-D158 CarbonylContact C-O 3.5Å; F152-D158 WeakPolarHBondContact CA-O 3.26Å; F152-D158 VanDerWaalsContact CB-O 3.29Å; F152-D158 WeakPolarHBondContact CB-O 3.49Å
153	C	89.3	Confident	88.5	Confident	0 Å²	0	64 Å²	64	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	128.2	175.9	177.5	0	0	0	0	111	C155 C156 K157 D158 W160 C166	C153-C155 PolarHBondContact O-N 2.99Å; C153-C155 VanDerWaalsContact O-N 3.13Å; C153-C155 PolarHBondContact SG-N 2.72Å; C153-C156 VanDerWaalsContact CB-SG 3.56Å; C153-K157 VanDerWaalsContact O-CA 3.25Å; C153-K157 WeakPolarHBondContact O-CA 3.37Å; C153-K157 PolarHBondContact O-N 2.74Å; C153-D158 PolarHBondContact N-O 2.91Å; C153-W160 HydrophobicContact CB-CE3 4.36Å; C153-C166 PolarHBondContact SG-SG 3.18Å
154	S	87.1	Confident	87	Confident	14 Å²	14	68.5 Å²	68.5	10%	0.098	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-25.7	177.2	65.7	0	0	0	0	113.5	V141 K157	V141-S154 PolarHBondContact N-OG 3.28Å; V141-S154 WeakPolarHBondContact O-CB 3.49Å; V141-S154 PolarHBondContact O-N 3.37Å; V141-S154 PolarHBondContact O-OG 3.01Å; S154-K157 PolarHBondContact O-NZ 2.69Å
155	C	81.2	Confident	85.7	Confident	42 Å²	42	68.9 Å²	68.9	28%	0.284	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-57.1	-174.5	-179.5	0	0	0	0	113.3	P140 C153 C166 R197	P140-C155 HydrophobicContact CB-CB 4.32Å; C153-C155 PolarHBondContact O-N 2.99Å; C153-C155 VanDerWaalsContact O-N 3.13Å; C153-C155 PolarHBondContact SG-N 2.72Å; C155-C166 VanDerWaalsContact CB-SG 3.54Å; C155-R197 PolarHBondContact O-NH2 3.03Å
156	C	82.1	Confident	84.6	Confident	25 Å²	25	70.1 Å²	70.1	17%	0.169	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-14.5	-178.3	67.7	0	0	0	0	114.7	C153 D158 H161 C166	C153-C156 VanDerWaalsContact CB-SG 3.56Å; C156-D158 PolarHBondContact O-N 3.47Å; C156-D158 PolarHBondContact SG-N 3.46Å; C156-D158 VanDerWaalsContact SG-N 3.44Å; C156-D158 PolarHBondContact SG-OD2 3.31Å; C156-D158 VanDerWaalsContact SG-OD2 3.41Å; C156-H161 PolarHBondContact SG-NE2 3.01Å; C156-H161 VanDerWaalsContact SG-NE2 3.38Å; C156-C166 HydrophobicContact CB-CB 4.09Å
157	K	87.3	Confident	82.8	Confident	74 Å²	74	76.6 Å²	76.6	32%	0.322	42%	0.416	S	S	.	.			trans	66.4	7.6	-174.6	-40.4	-58.4	-174.8	-158.8	0	116.2	T119 P122 F152 C153 S154	T119-K157 WeakPolarHBondContact OG1-CE 3.42Å; T119-K157 PolarHBondContact OG1-NZ 3.24Å; P122-K157 HydrophobicContact CB-CB 3.9Å; P122-K157 HydrophobicContact CG-CB 4.25Å; P122-K157 WeakPolarHBondContact CG-O 3.46Å; F152-K157 HydrophobicContact CD2-CD 4.33Å; F152-K157 HydrophobicContact CE2-CD 4.24Å; C153-K157 VanDerWaalsContact O-CA 3.25Å; C153-K157 WeakPolarHBondContact O-CA 3.37Å; C153-K157 PolarHBondContact O-N 2.74Å; S154-K157 PolarHBondContact O-NZ 2.69Å
158	D	86.9	Confident	80.6	Confident	97 Å²	97	79.7 Å²	79.7	52%	0.519	43%	0.426	S	S	.	.	S	Bend	trans	-76.7	175.6	168.8	-63	-50.1	0	0	0	111.8	F152 C153 C156	F152-D158 CarbonylContact C-O 3.5Å; F152-D158 WeakPolarHBondContact CA-O 3.26Å; F152-D158 VanDerWaalsContact CB-O 3.29Å; F152-D158 WeakPolarHBondContact CB-O 3.49Å; C153-D158 PolarHBondContact N-O 2.91Å; C156-D158 PolarHBondContact O-N 3.47Å; C156-D158 PolarHBondContact SG-N 3.46Å; C156-D158 VanDerWaalsContact SG-N 3.44Å; C156-D158 PolarHBondContact SG-OD2 3.31Å; C156-D158 VanDerWaalsContact SG-OD2 3.41Å
159	A	88.9	Confident	78.1	Confident	77 Å²	77	80.5 Å²	80.5	64%	0.636	43%	0.427	S	S	*	.	B	Isolated β-bridge	trans	-51.3	140.9	169	0	0	0	0	0	111.1	H161	A159-H161 PolarHBondContact O-N 3.22Å
160	W	89.6	Confident	75.7	Confident	98 Å²	98	81 Å²	81	37%	0.371	43%	0.429	S	S	.	.			trans	-55.6	137.6	-175.4	171.8	-112	0	0	0	113.3	V141 L142 C153	V141-W160 WeakPolarHBondContact O-CZ3 3.31Å; L142-W160 HydrophobicContact CB-CD2 3.55Å; L142-W160 HydrophobicContact CB-CE3 3.75Å; L142-W160 HydrophobicContact CB-CG 4.05Å; L142-W160 HydrophobicContact CB-CH2 4.16Å; L142-W160 HydrophobicContact CB-CZ2 3.98Å; L142-W160 HydrophobicContact CB-CZ3 4.08Å; L142-W160 HydrophobicContact CD1-CB 3.48Å; L142-W160 VanDerWaalsContact CD1-CB 3.48Å; L142-W160 HydrophobicContact CD1-CD2 3.9Å; L142-W160 HydrophobicContact CD1-CE3 4.43Å; L142-W160 HydrophobicContact CD1-CG 3.46Å; L142-W160 VanDerWaalsContact CD1-CG 3.46Å; L142-W160 HydrophobicContact CG-CD2 4.22Å; L142-W160 HydrophobicContact CG-CG 4.19Å; C153-W160 HydrophobicContact CB-CE3 4.36Å
161	H	84.4	Confident	73.1	Confident	41 Å²	41	81.1 Å²	81.1	19%	0.19	43%	0.434	C	S	.	.			trans	-139.4	133.4	179.8	57.9	81.5	0	0	0	110.4	C156 A159 V164 C166	C156-H161 PolarHBondContact SG-NE2 3.01Å; C156-H161 VanDerWaalsContact SG-NE2 3.38Å; A159-H161 PolarHBondContact O-N 3.22Å; H161-V164 PolarHBondContact CE1-O 3.49Å; H161-V164 PolarHBondContact ND1-O 2.85Å; H161-C166 VanDerWaalsContact CE1-SG 3.53Å
162	A	73.8	Confident	70.3	Confident	81 Å²	81	82.5 Å²	82.5	67%	0.669	45%	0.452	S	S	*	.	S	Bend	trans	-94.7	-23.7	-173.6	0	0	0	0	0	114.6
163	E	61.7	Low	67.7	Low	187 Å²	187	88.2 Å²	88.2	87%	0.874	49%	0.486	S	S	*	.	S	Bend	trans	-128.9	-7.8	-161.1	-53.4	-168.9	-160	0	0	114.9
164	V	62.4	Low	65	Low	96 Å²	96	95.1 Å²	95.1	58%	0.582	52%	0.522	S	S	*	.	S	Bend	trans	-106.8	123.7	176.9	-171.4	0	0	0	0	106.8	H161 C166	H161-V164 PolarHBondContact CE1-O 3.49Å; H161-V164 PolarHBondContact ND1-O 2.85Å; V164-C166 PolarHBondContact O-N 2.75Å
165	S	66.8	Low	62.5	Low	102 Å²	102	100.3 Å²	100.3	71%	0.713	56%	0.556	S	S	*	*			trans	-48.7	130.3	166.2	52.1	0	0	0	0	107.5	R167	S165-R167 WeakPolarHBondContact O-CA 3.32Å; S165-R167 PolarHBondContact O-N 3.45Å
166	C	73	Confident	60.3	Low	27 Å²	27	104 Å²	104	18%	0.182	58%	0.578	C	S	.	*			trans	-35.7	110.2	178.8	-70.8	0	0	0	0	108.7	C153 C155 C156 H161 V164 D168	C153-C166 PolarHBondContact SG-SG 3.18Å; C155-C166 VanDerWaalsContact CB-SG 3.54Å; C156-C166 HydrophobicContact CB-CB 4.09Å; H161-C166 VanDerWaalsContact CE1-SG 3.53Å; V164-C166 PolarHBondContact O-N 2.75Å; C166-D168 PolarHBondContact O-N 2.98Å
167	R	58	Low	58.1	Low	215 Å²	215	111.8 Å²	111.8	81%	0.811	61%	0.611	S	S	*	*			trans	-47.8	130.2	-169.2	-157.6	-178.6	-170.2	-150.6	3.3	107.5	S165 N169	S165-R167 WeakPolarHBondContact O-CA 3.32Å; S165-R167 PolarHBondContact O-N 3.45Å; R167-N169 PolarHBondContact O-N 3.42Å; R167-N169 VanDerWaalsContact O-N 3.16Å
168	D	49.6	Very low	55.7	Low	144 Å²	144	116 Å²	116	77%	0.77	63%	0.632	S	S	*	*			trans	-34.3	120.9	-172.4	-74.1	-53.4	0	0	0	111.1	C166 Q170	C166-D168 PolarHBondContact O-N 2.98Å; D168-Q170 VanDerWaalsContact C-N 3.29Å; D168-Q170 PolarHBondContact O-N 3.02Å
169	N	42.5	Very low	53.3	Low	69 Å²	69	123.3 Å²	123.3	37%	0.369	65%	0.652	S	S	.	*	S	Bend	trans	-31.3	80.3	-179.5	-82.2	-29.4	0	0	0	114.4	R167 R197 L223	R167-N169 PolarHBondContact O-N 3.42Å; R167-N169 VanDerWaalsContact O-N 3.16Å; N169-R197 PolarHBondContact OD1-NH1 3.2Å; N169-R197 PolarHBondContact OD1-NH2 2.87Å; N169-L223 HydrophobicContact CB-CD1 4.39Å
170	Q	44.3	Very low	50.7	Low	134 Å²	134	123.9 Å²	123.9	63%	0.626	66%	0.657	S	S	*	*			trans	-119	120.9	173	-78.8	-163	-14	0	0	109.7	D168 V172 D185	D168-Q170 VanDerWaalsContact C-N 3.29Å; D168-Q170 PolarHBondContact O-N 3.02Å; Q170-V172 PolarHBondContact O-N 3.4Å; Q170-D185 WeakPolarHBondContact CG-OD2 3.44Å; Q170-D185 PolarHBondContact NE2-OD2 2.98Å
171	P	39.6	Very low	48.2	Very low	69 Å²	69	126.3 Å²	126.3	45%	0.448	68%	0.676	S	S	.	*			trans	-64.2	122.2	162.9	25.8	-28.1	0	0	0	108.2	V173	P171-V173 HydrophobicContact CB-CG2 4.45Å; P171-V173 PolarHBondContact O-N 3.35Å
172	V	35.8	Very low	45.9	Very low	140 Å²	140	133.6 Å²	133.6	85%	0.848	71%	0.708	S	S	*	*			trans	-63.4	92.3	155.9	176.2	0	0	0	0	106.1	Q170 L174	Q170-V172 PolarHBondContact O-N 3.4Å; V172-L174 PolarHBondContact O-N 2.83Å
173	V	38.2	Very low	44.1	Very low	121 Å²	121	133.1 Å²	133.1	73%	0.733	71%	0.711	S	S	*	*			trans	-69.2	127.1	164	-179.4	0	0	0	0	106.4	P171	P171-V173 HydrophobicContact CB-CG2 4.45Å; P171-V173 PolarHBondContact O-N 3.35Å
174	L	32.6	Very low	43.4	Very low	144 Å²	144	130.2 Å²	130.2	75%	0.754	71%	0.706	S	S	*	*			trans	-41.4	148.2	174.3	-126.2	71.4	0	0	0	111.6	V172 T176	V172-L174 PolarHBondContact O-N 2.83Å; L174-T176 PolarHBondContact O-N 2.9Å
175	P	34.6	Very low	43.4	Very low	123 Å²	123	129 Å²	129	80%	0.799	70%	0.696	S	S	*	*			trans	-70.7	106.4	-172.8	28.8	-26.8	0	0	0	109.4
176	T	34.9	Very low	43.1	Very low	121 Å²	121	126.1 Å²	126.1	74%	0.742	68%	0.679	S	S	*	*			trans	-124.6	137.1	158.9	-45.5	0	0	0	0	107.8	L174 H178	L174-T176 PolarHBondContact O-N 2.9Å; T176-H178 PolarHBondContact O-N 2.85Å
177	E	35.2	Very low	42.9	Very low	187 Å²	187	132.6 Å²	132.6	87%	0.874	71%	0.706	S	S	*	*	S	Bend	trans	-78.2	28.5	-147.9	-46.5	-172.3	164.3	0	0	114.8
178	H	37.2	Very low	43.8	Very low	164 Å²	164	123.9 Å²	123.9	76%	0.759	68%	0.68	S	S	*	*			trans	-104.9	61.3	-179.8	-85.7	-103.1	0	0	0	111.6	T176 A180	T176-H178 PolarHBondContact O-N 2.85Å; H178-A180 VanDerWaalsContact C-N 3.29Å; H178-A180 PolarHBondContact O-N 3.37Å
179	R	37	Very low	45.3	Very low	250 Å²	250	121 Å²	121	94%	0.943	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	26.3	-174	-150.2	-173.6	-170.3	174	3.9	115.2
180	A	33.8	Very low	47.4	Very low	89 Å²	89	122.1 Å²	122.1	74%	0.736	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.7	6.3	-168	0	0	0	0	0	117.4	H178	H178-A180 VanDerWaalsContact C-N 3.29Å; H178-A180 PolarHBondContact O-N 3.37Å
181	L	36.4	Very low	49.4	Very low	149 Å²	149	117 Å²	117	78%	0.78	65%	0.65	S	S	*	*	S	Bend	trans	-133.8	10	-171.4	-74.8	175.9	0	0	0	118.2
182	F	37	Very low	51.5	Low	193 Å²	193	116.2 Å²	116.2	85%	0.846	64%	0.64	S	S	*	*			trans	-117.5	107.9	178.7	-60.3	-72.1	0	0	0	111
183	G	35.1	Very low	53.9	Low	71 Å²	71	109.5 Å²	109.5	73%	0.732	60%	0.6	S	S	*	*			trans	-64.7	-172	172.3	0	0	0	0	0	112.5	D185	G183-D185 PolarHBondContact O-N 2.91Å
184	T	46.6	Very low	56	Low	126 Å²	126	105.5 Å²	105.5	77%	0.773	58%	0.576	S	S	*	*			trans	-46	128.8	-177.7	45.9	0	0	0	0	112.7	A186	T184-A186 PolarHBondContact O-N 3.01Å
185	D	62.3	Low	58.2	Low	72 Å²	72	102 Å²	102	39%	0.385	56%	0.56	S	S	.	*	G	3₁₀ helix	trans	-47.6	-13.2	-173	-159.7	-20.4	0	0	0	116.2	Q170 G183 E187 A188 K191	Q170-D185 WeakPolarHBondContact CG-OD2 3.44Å; Q170-D185 PolarHBondContact NE2-OD2 2.98Å; G183-D185 PolarHBondContact O-N 2.91Å; D185-E187 VanDerWaalsContact C-N 3.25Å; D185-E187 PolarHBondContact O-N 3.22Å; D185-A188 PolarHBondContact O-N 2.89Å; D185-K191 PolarHBondContact O-NZ 3.04Å; D185-K191 IonicContact OD1-NZ 3.87Å; D185-K191 PolarHBondContact OD1-NZ 2.91Å
186	A	61.9	Low	60.1	Low	41 Å²	41	96.2 Å²	96.2	34%	0.339	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-64.4	-23.7	-177.3	0	0	0	0	0	114.6	T184 Y221	T184-A186 PolarHBondContact O-N 3.01Å; A186-Y221 HydrophobicContact CB-CD1 4.4Å; A186-Y221 WeakPolarHBondContact O-CD1 3.3Å
187	E	68.4	Low	62.1	Low	163 Å²	163	93.3 Å²	93.3	76%	0.762	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-109.6	8.2	-175	-68.4	-176.1	164.4	0	0	114.1	D185	D185-E187 VanDerWaalsContact C-N 3.25Å; D185-E187 PolarHBondContact O-N 3.22Å
188	A	76.5	Confident	64.2	Low	31 Å²	31	86.6 Å²	86.6	26%	0.256	47%	0.47	S	S	.	.			trans	-53.6	132.5	175.4	0	0	0	0	0	110.5	D185 I190 W220	D185-A188 PolarHBondContact O-N 2.89Å; A188-I190 PolarHBondContact O-N 2.94Å; A188-W220 WeakPolarHBondContact O-CZ2 3.41Å
189	P	82.2	Confident	66.5	Low	84 Å²	84	85.9 Å²	85.9	55%	0.545	46%	0.462	S	S	.	.	S	Bend	trans	-72.4	-18.7	-176.9	27.6	-34.6	0	0	0	113	E201 R202	P189-E201 CarbonylContact O-C 3.57Å; P189-E201 WeakPolarHBondContact O-CA 3.41Å; P189-R202 PolarHBondContact O-N 3.38Å
190	I	86.3	Confident	68.9	Low	93 Å²	93	75 Å²	75	48%	0.477	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	129.9	-178.2	-58.3	173	0	0	0	109.1	A188 Y199 I200 E201	A188-I190 PolarHBondContact O-N 2.94Å; I190-Y199 HydrophobicContact CG2-CD1 3.95Å; I190-Y199 HydrophobicContact CG2-CG 4.49Å; I190-I200 CarbonylContact C-O 3.48Å; I190-I200 WeakPolarHBondContact CA-O 3.12Å; I190-E201 HydrophobicContact CG1-CB 4.31Å; I190-E201 HydrophobicContact CG1-CG 4.27Å
191	K	86.4	Confident	71.4	Confident	27 Å²	27	76.8 Å²	76.8	12%	0.117	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	159.4	173.9	-64.9	-174.8	176	-71.8	0	111.1	D185 I200 W220 L223	D185-K191 PolarHBondContact O-NZ 3.04Å; D185-K191 IonicContact OD1-NZ 3.87Å; D185-K191 PolarHBondContact OD1-NZ 2.91Å; K191-I200 PolarHBondContact N-O 2.75Å; K191-I200 PolarHBondContact O-N 3.45Å; K191-I200 VanDerWaalsContact O-O 3.13Å; K191-W220 HydrophobicContact CB-CE3 4.12Å; K191-W220 HydrophobicContact CB-CH2 3.67Å; K191-W220 HydrophobicContact CB-CZ2 4.21Å; K191-W220 HydrophobicContact CB-CZ3 3.59Å; K191-W220 HydrophobicContact CD-CD2 3.84Å; K191-W220 HydrophobicContact CD-CE3 3.98Å; K191-W220 HydrophobicContact CD-CG 4.49Å; K191-W220 HydrophobicContact CD-CH2 4.24Å; K191-W220 HydrophobicContact CD-CZ2 3.99Å; K191-W220 HydrophobicContact CD-CZ3 4.21Å; K191-W220 WeakPolarHBondContact CD-O 3.45Å; K191-W220 HydrophobicContact CG-CD2 4.42Å; K191-W220 HydrophobicContact CG-CE3 4.3Å; K191-W220 HydrophobicContact CG-CH2 3.75Å; K191-W220 HydrophobicContact CG-CZ2 3.75Å; K191-W220 HydrophobicContact CG-CZ3 4.01Å; K191-L223 HydrophobicContact CD-CD2 4.32Å
192	Q	83.6	Confident	73.7	Confident	51 Å²	51	71.8 Å²	71.8	24%	0.238	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	145.3	174.7	-70.1	-177.1	-30.8	0	0	111.6	R197 V198 Y199	Q192-R197 WeakPolarHBondContact CG-O 3.12Å; Q192-V198 CarbonylContact C-O 3.57Å; Q192-V198 WeakPolarHBondContact CA-O 3.44Å; Q192-Y199 HydrophobicContact CG-CD1 3.65Å; Q192-Y199 HydrophobicContact CG-CE1 3.53Å; Q192-Y199 HydrophobicContact CG-CG 4.27Å; Q192-Y199 PolarHBondContact NE2-OH 2.67Å
193	C	85.8	Confident	75.6	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	38%	0.379	C	S	.	.			trans	-59.4	131.4	167.5	179.7	0	0	0	0	110.4	V195 R197 V198 I200 C211 C214	C193-V195 PolarHBondContact O-N 3.49Å; C193-R197 WeakPolarHBondContact O-CA 3.34Å; C193-R197 PolarHBondContact O-N 3.48Å; C193-V198 HydrophobicContact CB-CG2 4.02Å; C193-V198 PolarHBondContact N-O 3.42Å; C193-I200 HydrophobicContact CB-CD1 3.77Å; C193-C211 HydrophobicContact CB-CB 4.36Å; C193-C214 PolarHBondContact SG-SG 3.02Å
194	P	82.6	Confident	77.5	Confident	36 Å²	36	73.9 Å²	73.9	23%	0.234	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-20.8	-178.3	26.5	-35.1	0	0	0	113.6	F218 L223	P194-F218 HydrophobicContact CG-CB 3.97Å; P194-F218 HydrophobicContact CG-CD1 4.27Å; P194-F218 HydrophobicContact CG-CD2 4.22Å; P194-F218 HydrophobicContact CG-CG 3.89Å; P194-L223 HydrophobicContact CB-CB 4.42Å
195	V	78.2	Confident	79.2	Confident	71 Å²	71	69.9 Å²	69.9	43%	0.43	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-66.1	178.1	175.5	0	0	0	0	110.7	C193 H216	C193-V195 PolarHBondContact O-N 3.49Å; V195-H216 HydrophobicContact CB-CB 4.34Å; V195-H216 HydrophobicContact CG2-CB 4.06Å; V195-H216 VanDerWaalsContact CG2-CD2 3.49Å; V195-H216 WeakPolarHBondContact CG2-CD2 3.46Å
196	C	75.4	Confident	80.3	Confident	2 Å²	2	68.8 Å²	68.8	1%	0.014	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	4.4	-171.2	70.2	0	0	0	0	115	H113 V198 C211 C214	H113-C196 HydrophobicContact CB-CB 4.46Å; C196-V198 PolarHBondContact O-N 2.93Å; C196-V198 VanDerWaalsContact SG-CG2 3.57Å; C196-C211 PolarHBondContact SG-SG 3.46Å; C196-C214 HydrophobicContact CB-CB 3.89Å; C196-C214 PolarHBondContact SG-SG 3.29Å
197	R	75.6	Confident	81.6	Confident	59 Å²	59	66.9 Å²	66.9	22%	0.223	35%	0.349	C	S	.	.			trans	58.7	2.7	174.6	-57.7	-65.3	-171	151.9	-3.2	117.6	C155 N169 Q192 C193	C155-R197 PolarHBondContact O-NH2 3.03Å; N169-R197 PolarHBondContact OD1-NH1 3.2Å; N169-R197 PolarHBondContact OD1-NH2 2.87Å; Q192-R197 WeakPolarHBondContact CG-O 3.12Å; C193-R197 WeakPolarHBondContact O-CA 3.34Å; C193-R197 PolarHBondContact O-N 3.48Å
198	V	80.3	Confident	82.7	Confident	46 Å²	46	61.4 Å²	61.4	28%	0.279	32%	0.323	S	S	.	.			trans	-59.3	140.6	172	-57.1	0	0	0	0	110.6	Q192 C193 C196 I200 C211 N213	Q192-V198 CarbonylContact C-O 3.57Å; Q192-V198 WeakPolarHBondContact CA-O 3.44Å; C193-V198 HydrophobicContact CB-CG2 4.02Å; C193-V198 PolarHBondContact N-O 3.42Å; C196-V198 PolarHBondContact O-N 2.93Å; C196-V198 VanDerWaalsContact SG-CG2 3.57Å; V198-I200 HydrophobicContact CG2-CD1 4.48Å; V198-I200 HydrophobicContact CG2-CG1 4.2Å; V198-C211 VanDerWaalsContact CG2-SG 3.59Å; V198-N213 HydrophobicContact CG1-CB 4.2Å; V198-N213 WeakPolarHBondContact CG1-ND2 3.1Å; V198-N213 HydrophobicContact CG2-CB 4.07Å
199	Y	84.7	Confident	83.3	Confident	149 Å²	149	61.2 Å²	61.2	58%	0.584	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.6	134.8	174.1	-68.7	-81	0	0	0	110.2	I190 Q192	I190-Y199 HydrophobicContact CG2-CD1 3.95Å; I190-Y199 HydrophobicContact CG2-CG 4.49Å; Q192-Y199 HydrophobicContact CG-CD1 3.65Å; Q192-Y199 HydrophobicContact CG-CE1 3.53Å; Q192-Y199 HydrophobicContact CG-CG 4.27Å; Q192-Y199 PolarHBondContact NE2-OH 2.67Å
200	I	86.9	Confident	83.7	Confident	23 Å²	23	62.8 Å²	62.8	12%	0.118	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	125.6	-178.6	-62.8	172.1	0	0	0	106.6	I190 K191 C193 V198 M209 C211 F218 W220	I190-I200 CarbonylContact C-O 3.48Å; I190-I200 WeakPolarHBondContact CA-O 3.12Å; K191-I200 PolarHBondContact N-O 2.75Å; K191-I200 PolarHBondContact O-N 3.45Å; K191-I200 VanDerWaalsContact O-O 3.13Å; C193-I200 HydrophobicContact CB-CD1 3.77Å; V198-I200 HydrophobicContact CG2-CD1 4.48Å; V198-I200 HydrophobicContact CG2-CG1 4.2Å; I200-M209 HydrophobicContact CG2-CE 3.37Å; I200-M209 HydrophobicContact CG2-SD 4.39Å; I200-C211 HydrophobicContact CD1-CB 3.98Å; I200-F218 HydrophobicContact CD1-CE1 3.76Å; I200-F218 HydrophobicContact CD1-CZ 3.67Å; I200-W220 HydrophobicContact CB-CZ3 4.49Å; I200-W220 HydrophobicContact CG2-CZ3 4.26Å; I200-W220 VanDerWaalsContact O-CH2 3.32Å; I200-W220 WeakPolarHBondContact O-CH2 3.42Å
201	E	87.5	Confident	83.8	Confident	125 Å²	125	58.4 Å²	58.4	58%	0.584	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.5	141.4	169.4	-173.7	-179.4	-179.6	0	0	109.9	P189 I190	P189-E201 CarbonylContact O-C 3.57Å; P189-E201 WeakPolarHBondContact O-CA 3.41Å; I190-E201 HydrophobicContact CG1-CB 4.31Å; I190-E201 HydrophobicContact CG1-CG 4.27Å
202	R	85	Confident	83.7	Confident	45 Å²	45	65.9 Å²	65.9	17%	0.17	33%	0.329	C	S	.	.			trans	-101.6	111.9	174.4	-178.7	179.5	175.5	-160.4	-1.7	110.6	P189 E204 G205 M209 W220 Y221	P189-R202 PolarHBondContact O-N 3.38Å; R202-E204 PolarHBondContact O-N 3.43Å; R202-G205 PolarHBondContact NH2-O 3.03Å; R202-M209 HydrophobicContact CB-CE 4.09Å; R202-M209 HydrophobicContact CB-SD 4.04Å; R202-M209 HydrophobicContact CG-CE 4.39Å; R202-M209 HydrophobicContact CG-SD 4.13Å; R202-W220 HydrophobicContact CB-CD2 4.2Å; R202-W220 HydrophobicContact CB-CE3 4.47Å; R202-W220 HydrophobicContact CB-CH2 3.67Å; R202-W220 HydrophobicContact CB-CZ2 3.42Å; R202-W220 VanDerWaalsContact CB-CZ2 3.42Å; R202-W220 HydrophobicContact CB-CZ3 4.21Å; R202-W220 HydrophobicContact CG-CZ2 4.47Å; R202-W220 VanDerWaalsContact NH1-CD1 3.26Å; R202-Y221 VanDerWaalsContact NH1-CZ 3.32Å; R202-Y221 PolarHBondContact NH1-OH 2.84Å; R202-Y221 PolarHBondContact NH2-OH 3.44Å
203	N	75.6	Confident	83.6	Confident	132 Å²	132	64.1 Å²	64.1	71%	0.706	32%	0.321	S	S	*	.			trans	-84.4	39.6	-179.1	-54.3	-1.7	0	0	0	112.9
204	E	74.6	Confident	83.5	Confident	176 Å²	176	65.1 Å²	65.1	82%	0.822	33%	0.328	S	S	*	.	S	Bend	trans	62.5	174.9	-172.7	-53	-177.3	161.4	0	0	114.8	R202	R202-E204 PolarHBondContact O-N 3.43Å
205	G	82.7	Confident	83.7	Confident	42 Å²	42	69.3 Å²	69.3	43%	0.433	34%	0.343	S	S	.	.	S	Bend	trans	84.2	-129.4	179.7	0	0	0	0	0	114.6	R202 A207	R202-G205 PolarHBondContact NH2-O 3.03Å; G205-A207 PolarHBondContact O-N 2.89Å
206	C	86.7	Confident	84.1	Confident	49 Å²	49	66.6 Å²	66.6	33%	0.331	33%	0.325	S	S	.	.			trans	-61.2	130.5	-169.3	-171.3	0	0	0	0	112.6	Q208 L244	C206-Q208 PolarHBondContact SG-N 2.87Å; C206-Q208 VanDerWaalsContact SG-N 3.43Å; C206-L244 CarbonylContact C-O 3.59Å; C206-L244 VanDerWaalsContact CA-O 3.23Å; C206-L244 WeakPolarHBondContact CA-O 3.29Å
207	A	89.3	Confident	84.9	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	33%	0.329	C	S	.	.	S	Bend	trans	-86	-9	177.8	0	0	0	0	0	114.2	G205 M209 W220 Y221 Y235 K243 L244	G205-A207 PolarHBondContact O-N 2.89Å; A207-M209 PolarHBondContact O-N 2.85Å; A207-W220 HydrophobicContact CB-CB 4.49Å; A207-W220 WeakPolarHBondContact O-CB 3.32Å; A207-W220 PolarHBondContact O-N 3.39Å; A207-Y221 HydrophobicContact CB-CD2 3.94Å; A207-Y221 HydrophobicContact CB-CE2 3.48Å; A207-Y221 VanDerWaalsContact CB-CE2 3.48Å; A207-Y235 HydrophobicContact CB-CE1 3.93Å; A207-Y235 PolarHBondContact O-OH 3.27Å; A207-K243 WeakPolarHBondContact CB-O 3.41Å; A207-L244 PolarHBondContact N-O 3.31Å
208	Q	90	Very high	85.6	Confident	48 Å²	48	64.4 Å²	64.4	22%	0.224	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	107.1	169.6	179.8	168.4	-51.4	0	0	107.8	C206 T217 L226 L232 Y235 L244	C206-Q208 PolarHBondContact SG-N 2.87Å; C206-Q208 VanDerWaalsContact SG-N 3.43Å; Q208-T217 HydrophobicContact CG-CG2 3.47Å; Q208-T217 VanDerWaalsContact CG-CG2 3.47Å; Q208-L226 HydrophobicContact CB-CD1 4.46Å; Q208-L226 HydrophobicContact CG-CD1 4.04Å; Q208-L232 HydrophobicContact CB-CD2 4.37Å; Q208-Y235 WeakPolarHBondContact CA-OH 3.37Å; Q208-Y235 HydrophobicContact CB-CE2 4.11Å; Q208-Y235 PolarHBondContact N-OH 3.21Å; Q208-Y235 VanDerWaalsContact N-OH 3.11Å; Q208-L244 HydrophobicContact CB-CD1 4.23Å
209	M	89.6	Confident	86.1	Confident	27 Å²	27	62.2 Å²	62.2	13%	0.133	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	146.1	-176.1	-63.2	-164.1	72.9	0	0	110.5	I200 R202 A207 T217 F218 W220	I200-M209 HydrophobicContact CG2-CE 3.37Å; I200-M209 HydrophobicContact CG2-SD 4.39Å; R202-M209 HydrophobicContact CB-CE 4.09Å; R202-M209 HydrophobicContact CB-SD 4.04Å; R202-M209 HydrophobicContact CG-CE 4.39Å; R202-M209 HydrophobicContact CG-SD 4.13Å; A207-M209 PolarHBondContact O-N 2.85Å; M209-T217 CarbonylContact O-C 3.54Å; M209-T217 VanDerWaalsContact O-CA 3.24Å; M209-T217 WeakPolarHBondContact O-CA 3.36Å; M209-F218 HydrophobicContact CB-CE1 4.12Å; M209-F218 HydrophobicContact CB-CE2 4.38Å; M209-F218 HydrophobicContact CB-CZ 3.98Å; M209-F218 PolarHBondContact N-O 2.93Å; M209-F218 PolarHBondContact O-N 3.02Å; M209-W220 HydrophobicContact CE-CE3 4.29Å; M209-W220 HydrophobicContact CE-CZ3 4.08Å; M209-W220 HydrophobicContact CG-CB 4.42Å; M209-W220 HydrophobicContact CG-CE3 4.3Å; M209-W220 HydrophobicContact SD-CB 4.22Å; M209-W220 HydrophobicContact SD-CD2 3.61Å; M209-W220 HydrophobicContact SD-CE3 2.98Å; M209-W220 HydrophobicContact SD-CG 4.19Å; M209-W220 HydrophobicContact SD-CH2 4.24Å; M209-W220 HydrophobicContact SD-CZ3 3.34Å; M209-W220 WeakPolarHBondContact SD-CZ3 3.12Å
210	M	90.9	Very high	86.3	Confident	118 Å²	118	55.2 Å²	55.2	58%	0.581	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.4	120.7	171.6	-178.5	-176.3	-70.2	0	0	108.4	K212	M210-K212 PolarHBondContact O-N 3.44Å
211	C	88	Confident	86.4	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.007	28%	0.283	C	S	.	.			trans	-64	119.8	175.7	179.7	0	0	0	0	109.8	C193 C196 V198 I200 N213 C214 K215 H216 F218	C193-C211 HydrophobicContact CB-CB 4.36Å; C196-C211 PolarHBondContact SG-SG 3.46Å; V198-C211 VanDerWaalsContact CG2-SG 3.59Å; I200-C211 HydrophobicContact CD1-CB 3.98Å; C211-N213 PolarHBondContact O-N 3.24Å; C211-N213 PolarHBondContact SG-N 3.01Å; C211-C214 VanDerWaalsContact CB-SG 3.57Å; C211-C214 PolarHBondContact SG-N 3.46Å; C211-C214 VanDerWaalsContact SG-N 3.44Å; C211-K215 WeakPolarHBondContact O-CA 3.17Å; C211-K215 PolarHBondContact O-N 3.43Å; C211-H216 PolarHBondContact N-O 2.9Å; C211-F218 HydrophobicContact CB-CE1 4.43Å
212	K	84.9	Confident	86.3	Confident	183 Å²	183	53.7 Å²	53.7	80%	0.796	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-31	177.8	-69.9	-174.1	179.9	179	0	112.6	M210 K215	M210-K212 PolarHBondContact O-N 3.44Å; K212-K215 WeakPolarHBondContact O-CE 3.37Å; K212-K215 PolarHBondContact O-NZ 2.98Å
213	N	82.3	Confident	86.4	Confident	15 Å²	15	53.4 Å²	53.4	8%	0.08	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-74.7	177.7	-166.9	37.8	0	0	0	111	C69 R110 V198 C211 K215	C69-N213 PolarHBondContact O-OD1 2.92Å; R110-N213 VanDerWaalsContact CZ-O 3.3Å; R110-N213 VanDerWaalsContact NH1-C 3.26Å; R110-N213 PolarHBondContact NH1-O 2.86Å; R110-N213 PolarHBondContact NH1-OD1 2.61Å; R110-N213 PolarHBondContact NH2-O 2.99Å; V198-N213 HydrophobicContact CG1-CB 4.2Å; V198-N213 WeakPolarHBondContact CG1-ND2 3.1Å; V198-N213 HydrophobicContact CG2-CB 4.07Å; C211-N213 PolarHBondContact O-N 3.24Å; C211-N213 PolarHBondContact SG-N 3.01Å; N213-K215 PolarHBondContact O-N 3.24Å
214	C	81.8	Confident	86.9	Confident	20 Å²	20	52.4 Å²	52.4	14%	0.135	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-1.9	-173	65.8	0	0	0	0	115.5	L114 C193 C196 C211 H216	L114-C214 HydrophobicContact CD2-CB 3.65Å; C193-C214 PolarHBondContact SG-SG 3.02Å; C196-C214 HydrophobicContact CB-CB 3.89Å; C196-C214 PolarHBondContact SG-SG 3.29Å; C211-C214 VanDerWaalsContact CB-SG 3.57Å; C211-C214 PolarHBondContact SG-N 3.46Å; C211-C214 VanDerWaalsContact SG-N 3.44Å; C214-H216 PolarHBondContact O-N 2.98Å; C214-H216 WeakPolarHBondContact SG-CB 3.39Å
215	K	87.3	Confident	87.4	Confident	125 Å²	125	48.3 Å²	48.3	54%	0.543	25%	0.249	S	C	.	.			trans	61.8	1.7	-174.6	-51	-53.1	-174.1	-164.5	0	115.7	C211 K212 N213 T217	C211-K215 WeakPolarHBondContact O-CA 3.17Å; C211-K215 PolarHBondContact O-N 3.43Å; K212-K215 WeakPolarHBondContact O-CE 3.37Å; K212-K215 PolarHBondContact O-NZ 2.98Å; N213-K215 PolarHBondContact O-N 3.24Å; K215-T217 PolarHBondContact O-N 3.38Å
216	H	87.6	Confident	87.7	Confident	13 Å²	13	46.6 Å²	46.6	6%	0.06	23%	0.23	C	C	.	.			trans	-58.6	130.2	173.1	-176.6	65.5	0	0	0	111.4	V195 C211 C214 F218 N225 D227	V195-H216 HydrophobicContact CB-CB 4.34Å; V195-H216 HydrophobicContact CG2-CB 4.06Å; V195-H216 VanDerWaalsContact CG2-CD2 3.49Å; V195-H216 WeakPolarHBondContact CG2-CD2 3.46Å; C211-H216 PolarHBondContact N-O 2.9Å; C214-H216 PolarHBondContact O-N 2.98Å; C214-H216 WeakPolarHBondContact SG-CB 3.39Å; H216-F218 AromaticContact CD2-CD1 3.96Å; H216-N225 PolarHBondContact CE1-ND2 3.19Å; H216-D227 WeakPolarHBondContact CA-OD1 3.45Å; H216-D227 IonicContact CE1-OD2 3.95Å; H216-D227 PolarHBondContact CE1-OD2 2.99Å; H216-D227 IonicContact CG-OD1 3.55Å; H216-D227 IonicContact CG-OD2 3.66Å; H216-D227 IonicContact ND1-OD1 3.57Å; H216-D227 PolarHBondContact ND1-OD1 3.44Å; H216-D227 IonicContact ND1-OD2 3.04Å; H216-D227 PolarHBondContact ND1-OD2 2.9Å
217	T	91.2	Very high	87.6	Confident	15 Å²	15	47.5 Å²	47.5	9%	0.092	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	128.6	178.2	-55	0	0	0	0	109	Q208 M209 K215 L226 D227	Q208-T217 HydrophobicContact CG-CG2 3.47Å; Q208-T217 VanDerWaalsContact CG-CG2 3.47Å; M209-T217 CarbonylContact O-C 3.54Å; M209-T217 VanDerWaalsContact O-CA 3.24Å; M209-T217 WeakPolarHBondContact O-CA 3.36Å; K215-T217 PolarHBondContact O-N 3.38Å; T217-L226 HydrophobicContact CG2-CB 4.11Å; T217-L226 CarbonylContact O-C 3.58Å; T217-L226 WeakPolarHBondContact O-CA 3.33Å; T217-L226 PolarHBondContact O-N 3.1Å; T217-D227 PolarHBondContact N-OD1 3.3Å; T217-D227 PolarHBondContact O-N 2.89Å
218	F	91.1	Very high	87.3	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	160.3	-175.6	65.8	-81.1	0	0	0	112.3	P194 I200 M209 C211 H216 W220 L223 Q224	P194-F218 HydrophobicContact CG-CB 3.97Å; P194-F218 HydrophobicContact CG-CD1 4.27Å; P194-F218 HydrophobicContact CG-CD2 4.22Å; P194-F218 HydrophobicContact CG-CG 3.89Å; I200-F218 HydrophobicContact CD1-CE1 3.76Å; I200-F218 HydrophobicContact CD1-CZ 3.67Å; M209-F218 HydrophobicContact CB-CE1 4.12Å; M209-F218 HydrophobicContact CB-CE2 4.38Å; M209-F218 HydrophobicContact CB-CZ 3.98Å; M209-F218 PolarHBondContact N-O 2.93Å; M209-F218 PolarHBondContact O-N 3.02Å; C211-F218 HydrophobicContact CB-CE1 4.43Å; H216-F218 AromaticContact CD2-CD1 3.96Å; F218-W220 HydrophobicContact CE2-CE3 4.32Å; F218-L223 HydrophobicContact CD2-CD2 3.92Å; F218-L223 HydrophobicContact CE2-CD2 3.88Å; F218-Q224 WeakPolarHBondContact CA-O 3.31Å; F218-Q224 WeakPolarHBondContact CB-O 3.34Å
219	C	90.1	Very high	86.9	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	128.6	173.8	-179.9	0	0	0	0	110.7	Y221 C222 L223 Q224 L226 H234	C219-Y221 PolarHBondContact O-N 2.65Å; C219-C222 WeakPolarHBondContact CB-SG 3.1Å; C219-L223 WeakPolarHBondContact O-CA 2.92Å; C219-L223 PolarHBondContact O-N 3.27Å; C219-Q224 PolarHBondContact N-O 2.88Å; C219-Q224 VanDerWaalsContact N-O 3.11Å; C219-L226 HydrophobicContact CB-CD1 3.85Å; C219-L226 HydrophobicContact CB-CG 4.43Å; C219-H234 PolarHBondContact SG-NE2 3.43Å; C219-H234 VanDerWaalsContact SG-NE2 3.38Å
220	W	90.1	Very high	86.3	Confident	3 Å²	3	57.2 Å²	57.2	1%	0.011	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-35.6	178.4	-175.7	-108.7	0	0	0	114.1	A188 K191 I200 R202 A207 M209 F218	A188-W220 WeakPolarHBondContact O-CZ2 3.41Å; K191-W220 HydrophobicContact CB-CE3 4.12Å; K191-W220 HydrophobicContact CB-CH2 3.67Å; K191-W220 HydrophobicContact CB-CZ2 4.21Å; K191-W220 HydrophobicContact CB-CZ3 3.59Å; K191-W220 HydrophobicContact CD-CD2 3.84Å; K191-W220 HydrophobicContact CD-CE3 3.98Å; K191-W220 HydrophobicContact CD-CG 4.49Å; K191-W220 HydrophobicContact CD-CH2 4.24Å; K191-W220 HydrophobicContact CD-CZ2 3.99Å; K191-W220 HydrophobicContact CD-CZ3 4.21Å; K191-W220 WeakPolarHBondContact CD-O 3.45Å; K191-W220 HydrophobicContact CG-CD2 4.42Å; K191-W220 HydrophobicContact CG-CE3 4.3Å; K191-W220 HydrophobicContact CG-CH2 3.75Å; K191-W220 HydrophobicContact CG-CZ2 3.75Å; K191-W220 HydrophobicContact CG-CZ3 4.01Å; I200-W220 HydrophobicContact CB-CZ3 4.49Å; I200-W220 HydrophobicContact CG2-CZ3 4.26Å; I200-W220 VanDerWaalsContact O-CH2 3.32Å; I200-W220 WeakPolarHBondContact O-CH2 3.42Å; R202-W220 HydrophobicContact CB-CD2 4.2Å; R202-W220 HydrophobicContact CB-CE3 4.47Å; R202-W220 HydrophobicContact CB-CH2 3.67Å; R202-W220 HydrophobicContact CB-CZ2 3.42Å; R202-W220 VanDerWaalsContact CB-CZ2 3.42Å; R202-W220 HydrophobicContact CB-CZ3 4.21Å; R202-W220 HydrophobicContact CG-CZ2 4.47Å; R202-W220 VanDerWaalsContact NH1-CD1 3.26Å; A207-W220 HydrophobicContact CB-CB 4.49Å; A207-W220 WeakPolarHBondContact O-CB 3.32Å; A207-W220 PolarHBondContact O-N 3.39Å; M209-W220 HydrophobicContact CE-CE3 4.29Å; M209-W220 HydrophobicContact CE-CZ3 4.08Å; M209-W220 HydrophobicContact CG-CB 4.42Å; M209-W220 HydrophobicContact CG-CE3 4.3Å; M209-W220 HydrophobicContact SD-CB 4.22Å; M209-W220 HydrophobicContact SD-CD2 3.61Å; M209-W220 HydrophobicContact SD-CE3 2.98Å; M209-W220 HydrophobicContact SD-CG 4.19Å; M209-W220 HydrophobicContact SD-CH2 4.24Å; M209-W220 HydrophobicContact SD-CZ3 3.34Å; M209-W220 WeakPolarHBondContact SD-CZ3 3.12Å; F218-W220 HydrophobicContact CE2-CE3 4.32Å
221	Y	87.6	Confident	85.8	Confident	62 Å²	62	58.2 Å²	58.2	24%	0.243	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-37.6	-171.5	-64.4	-73.6	0	0	0	113.6	A186 R202 A207 C219 K243	A186-Y221 HydrophobicContact CB-CD1 4.4Å; A186-Y221 WeakPolarHBondContact O-CD1 3.3Å; R202-Y221 VanDerWaalsContact NH1-CZ 3.32Å; R202-Y221 PolarHBondContact NH1-OH 2.84Å; R202-Y221 PolarHBondContact NH2-OH 3.44Å; A207-Y221 HydrophobicContact CB-CD2 3.94Å; A207-Y221 HydrophobicContact CB-CE2 3.48Å; A207-Y221 VanDerWaalsContact CB-CE2 3.48Å; C219-Y221 PolarHBondContact O-N 2.65Å; Y221-K243 HydrophobicContact CD1-CD 4.4Å; Y221-K243 HydrophobicContact CD2-CB 3.82Å; Y221-K243 HydrophobicContact CD2-CD 4.05Å; Y221-K243 HydrophobicContact CE1-CD 4.49Å; Y221-K243 HydrophobicContact CE2-CB 3.55Å; Y221-K243 HydrophobicContact CE2-CD 4.18Å; Y221-K243 HydrophobicContact CE2-CG 4.42Å; Y221-K243 WeakPolarHBondContact CE2-O 3.44Å; Y221-K243 HydrophobicContact CG-CD 4.16Å
222	C	86.7	Confident	85.7	Confident	53 Å²	53	59.1 Å²	59.1	36%	0.358	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-2.8	-175	67.2	0	0	0	0	113.5	C219 Q224 H234 C240	C219-C222 WeakPolarHBondContact CB-SG 3.1Å; C222-Q224 PolarHBondContact O-N 2.84Å; C222-Q224 VanDerWaalsContact SG-CB 3.53Å; C222-H234 PolarHBondContact SG-CE1 3.19Å; C222-H234 PolarHBondContact SG-NE2 2.74Å; C222-C240 VanDerWaalsContact SG-SG 3.65Å
223	L	86.7	Confident	85.7	Confident	40 Å²	40	58.6 Å²	58.6	21%	0.209	28%	0.284	C	S	.	.			trans	57.8	15.5	-179.2	-53.2	178.4	0	0	0	114.7	N169 K191 P194 F218 C219	N169-L223 HydrophobicContact CB-CD1 4.39Å; K191-L223 HydrophobicContact CD-CD2 4.32Å; P194-L223 HydrophobicContact CB-CB 4.42Å; F218-L223 HydrophobicContact CD2-CD2 3.92Å; F218-L223 HydrophobicContact CE2-CD2 3.88Å; C219-L223 WeakPolarHBondContact O-CA 2.92Å; C219-L223 PolarHBondContact O-N 3.27Å
224	Q	85.1	Confident	86	Confident	110 Å²	110	59.4 Å²	59.4	51%	0.514	29%	0.287	S	S	.	.			trans	-67.5	141.3	178.7	-170.3	173.4	-1.7	0	0	111.1	F218 C219 C222 L226 H234	F218-Q224 WeakPolarHBondContact CA-O 3.31Å; F218-Q224 WeakPolarHBondContact CB-O 3.34Å; C219-Q224 PolarHBondContact N-O 2.88Å; C219-Q224 VanDerWaalsContact N-O 3.11Å; C222-Q224 PolarHBondContact O-N 2.84Å; C222-Q224 VanDerWaalsContact SG-CB 3.53Å; Q224-L226 PolarHBondContact O-N 2.88Å; Q224-H234 PolarHBondContact OE1-CE1 2.83Å; Q224-H234 PolarHBondContact OE1-ND1 3.41Å
225	N	86.9	Confident	86.3	Confident	90 Å²	90	58.7 Å²	58.7	48%	0.481	28%	0.281	S	S	.	.	B	Isolated β-bridge	trans	-61.1	123.5	172.8	-179	-20.9	0	0	0	110.7	H216 D227	H216-N225 PolarHBondContact CE1-ND2 3.19Å; N225-D227 WeakPolarHBondContact OD1-CB 3.35Å; N225-D227 PolarHBondContact OD1-N 2.89Å; N225-D227 PolarHBondContact OD1-OD2 3.38Å
226	L	88.8	Confident	86.3	Confident	7 Å²	7	55.9 Å²	55.9	4%	0.037	27%	0.273	C	S	.	.			trans	-122.4	18	177.9	-61.9	-174.6	0	0	0	113	Q208 T217 C219 Q224 N228 D229 H234 Y235	Q208-L226 HydrophobicContact CB-CD1 4.46Å; Q208-L226 HydrophobicContact CG-CD1 4.04Å; T217-L226 HydrophobicContact CG2-CB 4.11Å; T217-L226 CarbonylContact O-C 3.58Å; T217-L226 WeakPolarHBondContact O-CA 3.33Å; T217-L226 PolarHBondContact O-N 3.1Å; C219-L226 HydrophobicContact CB-CD1 3.85Å; C219-L226 HydrophobicContact CB-CG 4.43Å; Q224-L226 PolarHBondContact O-N 2.88Å; L226-N228 PolarHBondContact O-N 3.41Å; L226-N228 VanDerWaalsContact O-N 3.11Å; L226-D229 HydrophobicContact CB-CB 4.17Å; L226-D229 HydrophobicContact CD2-CB 3.97Å; L226-D229 PolarHBondContact O-N 2.82Å; L226-H234 HydrophobicContact CD1-CB 4.41Å; L226-H234 HydrophobicContact CD2-CB 3.57Å; L226-Y235 HydrophobicContact CD1-CE2 4.05Å
227	D	83.3	Confident	86.2	Confident	68 Å²	68	63.3 Å²	63.3	36%	0.364	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-35.6	-179.2	-72.2	-32.2	0	0	0	112.5	H216 T217 N225	H216-D227 WeakPolarHBondContact CA-OD1 3.45Å; H216-D227 IonicContact CE1-OD2 3.95Å; H216-D227 PolarHBondContact CE1-OD2 2.99Å; H216-D227 IonicContact CG-OD1 3.55Å; H216-D227 IonicContact CG-OD2 3.66Å; H216-D227 IonicContact ND1-OD1 3.57Å; H216-D227 PolarHBondContact ND1-OD1 3.44Å; H216-D227 IonicContact ND1-OD2 3.04Å; H216-D227 PolarHBondContact ND1-OD2 2.9Å; T217-D227 PolarHBondContact N-OD1 3.3Å; T217-D227 PolarHBondContact O-N 2.89Å; N225-D227 WeakPolarHBondContact OD1-CB 3.35Å; N225-D227 PolarHBondContact OD1-N 2.89Å; N225-D227 PolarHBondContact OD1-OD2 3.38Å
228	N	83.6	Confident	85.9	Confident	149 Å²	149	65.2 Å²	65.2	80%	0.797	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-1.1	179.4	-62.9	-45.7	0	0	0	113.8	L226 I230	L226-N228 PolarHBondContact O-N 3.41Å; L226-N228 VanDerWaalsContact O-N 3.11Å; N228-I230 PolarHBondContact O-N 3.01Å; N228-I230 VanDerWaalsContact O-N 3.09Å
229	D	82.3	Confident	85.7	Confident	25 Å²	25	70.6 Å²	70.6	13%	0.134	36%	0.362	C	S	.	.			trans	-89.3	57.7	-179.6	-168.3	20.3	0	0	0	112.1	L226 F231 L232 R233 H234	L226-D229 HydrophobicContact CB-CB 4.17Å; L226-D229 HydrophobicContact CD2-CB 3.97Å; L226-D229 PolarHBondContact O-N 2.82Å; D229-F231 PolarHBondContact O-N 3.13Å; D229-F231 VanDerWaalsContact O-N 3.07Å; D229-L232 PolarHBondContact O-N 2.72Å; D229-L232 VanDerWaalsContact O-N 3.1Å; D229-L232 PolarHBondContact OD1-N 3.2Å; D229-R233 VanDerWaalsContact CG-N 3.32Å; D229-R233 WeakPolarHBondContact OD1-CB 3.28Å; D229-R233 PolarHBondContact OD1-N 3.33Å; D229-R233 PolarHBondContact OD2-N 2.71Å; D229-H234 WeakPolarHBondContact OD2-CB 3.26Å; D229-H234 PolarHBondContact OD2-N 2.87Å
230	I	76.9	Confident	85.6	Confident	104 Å²	104	70.8 Å²	70.8	53%	0.533	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-23.7	179.4	-56	169.5	0	0	0	111.6	N228	N228-I230 PolarHBondContact O-N 3.01Å; N228-I230 VanDerWaalsContact O-N 3.09Å
231	F	80.7	Confident	85.5	Confident	140 Å²	140	78 Å²	78	61%	0.614	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	3.5	-177.2	-65.8	-69.6	0	0	0	113.9	D229 R233 R248	D229-F231 PolarHBondContact O-N 3.13Å; D229-F231 VanDerWaalsContact O-N 3.07Å; F231-R233 HydrophobicContact CB-CG 3.79Å; F231-R233 PolarHBondContact O-N 2.77Å; F231-R248 PolarHBondContact O-NE 3.46Å; F231-R248 PolarHBondContact O-NH1 3.35Å; F231-R248 PolarHBondContact O-NH2 2.77Å
232	L	84	Confident	85.3	Confident	20 Å²	20	81.4 Å²	81.4	11%	0.105	41%	0.413	C	S	.	.			trans	60.6	28	177.4	-54.7	156.2	0	0	0	112.8	Q208 D229 H234 Y235 L244 R248	Q208-L232 HydrophobicContact CB-CD2 4.37Å; D229-L232 PolarHBondContact O-N 2.72Å; D229-L232 VanDerWaalsContact O-N 3.1Å; D229-L232 PolarHBondContact OD1-N 3.2Å; L232-H234 PolarHBondContact O-N 2.78Å; L232-Y235 HydrophobicContact CB-CD2 4.37Å; L232-Y235 HydrophobicContact CD2-CE2 4.48Å; L232-Y235 PolarHBondContact O-N 2.89Å; L232-L244 HydrophobicContact CB-CD2 4.29Å; L232-L244 HydrophobicContact CD1-CD2 3.94Å; L232-L244 HydrophobicContact CD2-CD1 3.84Å; L232-L244 HydrophobicContact CD2-CD2 4.07Å; L232-L244 HydrophobicContact CG-CD2 4.34Å; L232-R248 HydrophobicContact CB-CG 4.25Å; L232-R248 HydrophobicContact CD1-CG 4.2Å; L232-R248 PolarHBondContact O-NH1 3.21Å
233	R	85.9	Confident	85.3	Confident	172 Å²	172	83.2 Å²	83.2	65%	0.649	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-67.9	-25.5	-174.6	-64.8	-177.6	70	159.3	0.8	112.3	D229 F231 Y235 D236	D229-R233 VanDerWaalsContact CG-N 3.32Å; D229-R233 WeakPolarHBondContact OD1-CB 3.28Å; D229-R233 PolarHBondContact OD1-N 3.33Å; D229-R233 PolarHBondContact OD2-N 2.71Å; F231-R233 HydrophobicContact CB-CG 3.79Å; F231-R233 PolarHBondContact O-N 2.77Å; R233-Y235 PolarHBondContact O-N 3.38Å; R233-Y235 VanDerWaalsContact O-N 3.16Å; R233-D236 PolarHBondContact O-N 2.66Å; R233-D236 VanDerWaalsContact O-N 3.11Å
234	H	88.7	Confident	85.3	Confident	31 Å²	31	81.6 Å²	81.6	14%	0.144	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-53.1	-32.9	174	179.4	79	0	0	0	112.5	C219 C222 Q224 L226 D229 L232 C240	C219-H234 PolarHBondContact SG-NE2 3.43Å; C219-H234 VanDerWaalsContact SG-NE2 3.38Å; C222-H234 PolarHBondContact SG-CE1 3.19Å; C222-H234 PolarHBondContact SG-NE2 2.74Å; Q224-H234 PolarHBondContact OE1-CE1 2.83Å; Q224-H234 PolarHBondContact OE1-ND1 3.41Å; L226-H234 HydrophobicContact CD1-CB 4.41Å; L226-H234 HydrophobicContact CD2-CB 3.57Å; D229-H234 WeakPolarHBondContact OD2-CB 3.26Å; D229-H234 PolarHBondContact OD2-N 2.87Å; L232-H234 PolarHBondContact O-N 2.78Å; H234-C240 WeakPolarHBondContact NE2-CB 3.28Å; H234-C240 PolarHBondContact NE2-SG 2.86Å; H234-C240 VanDerWaalsContact NE2-SG 3.36Å
235	Y	88.8	Confident	85.1	Confident	5 Å²	5	79 Å²	79	2%	0.02	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-88.3	2.8	-176.8	-59.3	-84.9	0	0	0	114.6	A207 Q208 L226 L232 R233 C240 R241 N242 L244	A207-Y235 HydrophobicContact CB-CE1 3.93Å; A207-Y235 PolarHBondContact O-OH 3.27Å; Q208-Y235 WeakPolarHBondContact CA-OH 3.37Å; Q208-Y235 HydrophobicContact CB-CE2 4.11Å; Q208-Y235 PolarHBondContact N-OH 3.21Å; Q208-Y235 VanDerWaalsContact N-OH 3.11Å; L226-Y235 HydrophobicContact CD1-CE2 4.05Å; L232-Y235 HydrophobicContact CB-CD2 4.37Å; L232-Y235 HydrophobicContact CD2-CE2 4.48Å; L232-Y235 PolarHBondContact O-N 2.89Å; R233-Y235 PolarHBondContact O-N 3.38Å; R233-Y235 VanDerWaalsContact O-N 3.16Å; Y235-C240 HydrophobicContact CD1-CB 4.47Å; Y235-C240 WeakPolarHBondContact CD1-O 3.45Å; Y235-R241 VanDerWaalsContact O-CA 3.28Å; Y235-R241 WeakPolarHBondContact O-CA 3.46Å; Y235-N242 PolarHBondContact O-N 3.5Å; Y235-L244 HydrophobicContact CD1-CB 3.87Å; Y235-L244 HydrophobicContact CD1-CD1 4.38Å; Y235-L244 HydrophobicContact CD2-CB 4.27Å; Y235-L244 HydrophobicContact CD2-CD1 3.72Å; Y235-L244 HydrophobicContact CD2-CG 4.39Å; Y235-L244 HydrophobicContact CE1-CB 4.35Å; Y235-L244 HydrophobicContact CE1-CD1 4.23Å; Y235-L244 HydrophobicContact CE2-CD1 3.56Å; Y235-L244 HydrophobicContact CG-CB 3.82Å; Y235-L244 HydrophobicContact CG-CD1 4.14Å; Y235-L244 HydrophobicContact CG-CG 4.43Å
236	D	86.1	Confident	84.6	Confident	67 Å²	67	78.1 Å²	78.1	36%	0.358	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-85.7	-25	178.8	-67.1	-20.1	0	0	0	113	R233 R241 R248	R233-D236 PolarHBondContact O-N 2.66Å; R233-D236 VanDerWaalsContact O-N 3.11Å; D236-R241 WeakPolarHBondContact O-CD 3.33Å; D236-R241 WeakPolarHBondContact O-CG 2.98Å; D236-R241 PolarHBondContact O-NE 3.11Å; D236-R248 IonicContact OD1-CZ 3.94Å; D236-R248 IonicContact OD1-NE 3.42Å; D236-R248 IonicContact OD1-NH1 3.94Å; D236-R248 PolarHBondContact OD1-NH1 3.47Å; D236-R248 IonicContact OD2-CZ 2.77Å; D236-R248 IonicContact OD2-NH1 3.33Å; D236-R248 PolarHBondContact OD2-NH1 2.88Å; D236-R248 IonicContact OD2-NH2 3.19Å
237	K	84.8	Confident	83.9	Confident	169 Å²	169	81.3 Å²	81.3	74%	0.735	43%	0.425	S	S	*	.	S	Bend	trans	-144.9	167.5	-170.6	-61.6	-174.3	-176.5	-176.7	0	111.3
238	G	86.1	Confident	83.4	Confident	55 Å²	55	81 Å²	81	57%	0.567	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	71.3	-163.1	174.5	0	0	0	0	0	114.4	C240 R241	G238-C240 PolarHBondContact O-N 3.43Å; G238-R241 VanDerWaalsContact O-CB 3.29Å; G238-R241 WeakPolarHBondContact O-CB 3.47Å; G238-R241 PolarHBondContact O-N 3.3Å; G238-R241 VanDerWaalsContact O-N 3.16Å
239	P	85.8	Confident	82.8	Confident	112 Å²	112	77 Å²	77	73%	0.727	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-69.5	-15.7	-170.8	27.7	-35.4	0	0	0	114.5	K243	P239-K243 WeakPolarHBondContact O-CE 3.48Å; P239-K243 PolarHBondContact O-NZ 2.98Å
240	C	88.6	Confident	82.3	Confident	4 Å²	4	78.8 Å²	78.8	3%	0.027	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-100.7	5.9	178.3	-63.3	0	0	0	0	113.2	C222 H234 Y235 G238 N242 K243	C222-C240 VanDerWaalsContact SG-SG 3.65Å; H234-C240 WeakPolarHBondContact NE2-CB 3.28Å; H234-C240 PolarHBondContact NE2-SG 2.86Å; H234-C240 VanDerWaalsContact NE2-SG 3.36Å; Y235-C240 HydrophobicContact CD1-CB 4.47Å; Y235-C240 WeakPolarHBondContact CD1-O 3.45Å; G238-C240 PolarHBondContact O-N 3.43Å; C240-N242 PolarHBondContact O-N 3.04Å; C240-K243 WeakPolarHBondContact O-CB 3.42Å; C240-K243 PolarHBondContact O-N 2.93Å; C240-K243 VanDerWaalsContact O-N 3.12Å
241	R	87.9	Confident	82	Confident	154 Å²	154	76.2 Å²	76.2	58%	0.581	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	132.7	179.4	-176.3	176.3	179.5	-158.8	-0.9	111.5	Y235 D236 G238 K243	Y235-R241 VanDerWaalsContact O-CA 3.28Å; Y235-R241 WeakPolarHBondContact O-CA 3.46Å; D236-R241 WeakPolarHBondContact O-CD 3.33Å; D236-R241 WeakPolarHBondContact O-CG 2.98Å; D236-R241 PolarHBondContact O-NE 3.11Å; G238-R241 VanDerWaalsContact O-CB 3.29Å; G238-R241 WeakPolarHBondContact O-CB 3.47Å; G238-R241 PolarHBondContact O-N 3.3Å; G238-R241 VanDerWaalsContact O-N 3.16Å; R241-K243 PolarHBondContact O-N 2.95Å; R241-K243 VanDerWaalsContact O-N 3.14Å
242	N	84.6	Confident	81.7	Confident	135 Å²	135	75.2 Å²	75.2	72%	0.722	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	10.2	-179.8	-57.2	-32.1	0	0	0	115.7	Y235 C240 L244	Y235-N242 PolarHBondContact O-N 3.5Å; C240-N242 PolarHBondContact O-N 3.04Å; N242-L244 VanDerWaalsContact C-N 3.34Å
243	K	86.6	Confident	81.3	Confident	91 Å²	91	83.1 Å²	83.1	40%	0.396	44%	0.437	S	S	.	.			trans	-91.5	12.7	179.5	-62.1	-171.8	179.1	162.7	0	114	A207 Y221 P239 C240 R241 G245	A207-K243 WeakPolarHBondContact CB-O 3.41Å; Y221-K243 HydrophobicContact CD1-CD 4.4Å; Y221-K243 HydrophobicContact CD2-CB 3.82Å; Y221-K243 HydrophobicContact CD2-CD 4.05Å; Y221-K243 HydrophobicContact CE1-CD 4.49Å; Y221-K243 HydrophobicContact CE2-CB 3.55Å; Y221-K243 HydrophobicContact CE2-CD 4.18Å; Y221-K243 HydrophobicContact CE2-CG 4.42Å; Y221-K243 WeakPolarHBondContact CE2-O 3.44Å; Y221-K243 HydrophobicContact CG-CD 4.16Å; P239-K243 WeakPolarHBondContact O-CE 3.48Å; P239-K243 PolarHBondContact O-NZ 2.98Å; C240-K243 WeakPolarHBondContact O-CB 3.42Å; C240-K243 PolarHBondContact O-N 2.93Å; C240-K243 VanDerWaalsContact O-N 3.12Å; R241-K243 PolarHBondContact O-N 2.95Å; R241-K243 VanDerWaalsContact O-N 3.14Å; K243-G245 VanDerWaalsContact C-N 3.27Å; K243-G245 PolarHBondContact O-N 3.42Å
244	L	85.3	Confident	80.9	Confident	5 Å²	5	79.5 Å²	79.5	3%	0.026	43%	0.43	C	S	.	.	S	Bend	trans	-65.8	-29.1	-177.1	-176.7	59.4	0	0	0	112.9	C206 A207 Q208 L232 Y235 N242 H246 R248	C206-L244 CarbonylContact C-O 3.59Å; C206-L244 VanDerWaalsContact CA-O 3.23Å; C206-L244 WeakPolarHBondContact CA-O 3.29Å; A207-L244 PolarHBondContact N-O 3.31Å; Q208-L244 HydrophobicContact CB-CD1 4.23Å; L232-L244 HydrophobicContact CB-CD2 4.29Å; L232-L244 HydrophobicContact CD1-CD2 3.94Å; L232-L244 HydrophobicContact CD2-CD1 3.84Å; L232-L244 HydrophobicContact CD2-CD2 4.07Å; L232-L244 HydrophobicContact CG-CD2 4.34Å; Y235-L244 HydrophobicContact CD1-CB 3.87Å; Y235-L244 HydrophobicContact CD1-CD1 4.38Å; Y235-L244 HydrophobicContact CD2-CB 4.27Å; Y235-L244 HydrophobicContact CD2-CD1 3.72Å; Y235-L244 HydrophobicContact CD2-CG 4.39Å; Y235-L244 HydrophobicContact CE1-CB 4.35Å; Y235-L244 HydrophobicContact CE1-CD1 4.23Å; Y235-L244 HydrophobicContact CE2-CD1 3.56Å; Y235-L244 HydrophobicContact CG-CB 3.82Å; Y235-L244 HydrophobicContact CG-CD1 4.14Å; Y235-L244 HydrophobicContact CG-CG 4.43Å; N242-L244 VanDerWaalsContact C-N 3.34Å; L244-H246 WeakPolarHBondContact CD2-CE1 3.18Å; L244-R248 HydrophobicContact CD2-CG 3.93Å
245	G	80.8	Confident	80.6	Confident	55 Å²	55	85 Å²	85	57%	0.567	45%	0.45	S	S	*	.	S	Bend	trans	88.9	-5.9	-177.8	0	0	0	0	0	114.8	K243	K243-G245 VanDerWaalsContact C-N 3.27Å; K243-G245 PolarHBondContact O-N 3.42Å
246	H	77.3	Confident	80.4	Confident	72 Å²	72	89.5 Å²	89.5	33%	0.333	48%	0.478	S	S	.	.	S	Bend	trans	-149.6	163.1	168.1	62	72.2	0	0	0	110.7	L244 V251	L244-H246 WeakPolarHBondContact CD2-CE1 3.18Å; H246-V251 WeakPolarHBondContact CE1-CG2 3.43Å
247	S	74.9	Confident	80.5	Confident	75 Å²	75	90.9 Å²	90.9	52%	0.524	48%	0.482	S	S	.	.			trans	-68.8	141.5	174.1	-176.4	0	0	0	0	110.8	A249 S250	S247-A249 PolarHBondContact O-N 2.96Å; S247-A249 PolarHBondContact OG-N 2.87Å; S247-S250 PolarHBondContact O-OG 3.45Å
248	R	72.2	Confident	80.7	Confident	61 Å²	61	86.2 Å²	86.2	23%	0.23	47%	0.468	C	S	.	.	H	α-helix	trans	-67.9	-28.9	170.6	-73.3	177.9	54.1	165.4	-11.9	112	F231 L232 D236 L244 S250 V251 M252	F231-R248 PolarHBondContact O-NE 3.46Å; F231-R248 PolarHBondContact O-NH1 3.35Å; F231-R248 PolarHBondContact O-NH2 2.77Å; L232-R248 HydrophobicContact CB-CG 4.25Å; L232-R248 HydrophobicContact CD1-CG 4.2Å; L232-R248 PolarHBondContact O-NH1 3.21Å; D236-R248 IonicContact OD1-CZ 3.94Å; D236-R248 IonicContact OD1-NE 3.42Å; D236-R248 IonicContact OD1-NH1 3.94Å; D236-R248 PolarHBondContact OD1-NH1 3.47Å; D236-R248 IonicContact OD2-CZ 2.77Å; D236-R248 IonicContact OD2-NH1 3.33Å; D236-R248 PolarHBondContact OD2-NH1 2.88Å; D236-R248 IonicContact OD2-NH2 3.19Å; L244-R248 HydrophobicContact CD2-CG 3.93Å; R248-S250 VanDerWaalsContact C-N 3.28Å; R248-S250 PolarHBondContact O-N 3.33Å; R248-V251 PolarHBondContact O-N 2.78Å; R248-M252 PolarHBondContact O-N 3.47Å; R248-M252 VanDerWaalsContact O-N 3.08Å
249	A	71.4	Confident	80.9	Confident	64 Å²	64	87.9 Å²	87.9	53%	0.529	47%	0.467	S	S	.	.	H	α-helix	trans	-62.5	-35.4	179.3	0	0	0	0	0	111.8	S247 W253	S247-A249 PolarHBondContact O-N 2.96Å; S247-A249 PolarHBondContact OG-N 2.87Å; A249-W253 WeakPolarHBondContact O-CB 3.35Å; A249-W253 PolarHBondContact O-N 3.44Å
250	S	71.2	Confident	81.2	Confident	64 Å²	64	84.7 Å²	84.7	45%	0.448	45%	0.454	S	S	.	.	H	α-helix	trans	-68	-37.6	177.6	61.8	0	0	0	0	112.3	S247 R248 N254	S247-S250 PolarHBondContact O-OG 3.45Å; R248-S250 VanDerWaalsContact C-N 3.28Å; R248-S250 PolarHBondContact O-N 3.33Å; S250-N254 VanDerWaalsContact O-CB 3.31Å; S250-N254 WeakPolarHBondContact O-CB 3.25Å; S250-N254 PolarHBondContact O-N 3Å
251	V	71.6	Confident	81.5	Confident	49 Å²	49	88.7 Å²	88.7	30%	0.297	47%	0.474	S	S	.	.	H	α-helix	trans	-67.9	-45.1	176.6	179.9	0	0	0	0	111.2	H246 R248 N254 R255	H246-V251 WeakPolarHBondContact CE1-CG2 3.43Å; R248-V251 PolarHBondContact O-N 2.78Å; V251-N254 PolarHBondContact O-N 3.35Å; V251-R255 PolarHBondContact O-N 3.17Å
252	M	73.8	Confident	81.7	Confident	120 Å²	120	86.9 Å²	86.9	59%	0.591	48%	0.475	S	S	*	.	H	α-helix	trans	-65.1	-42.2	176.4	-69.5	-173.8	69.7	0	0	111.6	R248 R255 T256	R248-M252 PolarHBondContact O-N 3.47Å; R248-M252 VanDerWaalsContact O-N 3.08Å; M252-R255 PolarHBondContact O-N 3.38Å; M252-T256 PolarHBondContact O-N 3.03Å; M252-T256 PolarHBondContact O-OG1 3.44Å
253	W	75.8	Confident	82.1	Confident	186 Å²	186	84.4 Å²	84.4	71%	0.705	47%	0.465	S	S	*	.	H	α-helix	trans	-59.4	-47.8	175.7	-174.5	-91.2	0	0	0	111.6	A249 R255 T256 Q257	A249-W253 WeakPolarHBondContact O-CB 3.35Å; A249-W253 PolarHBondContact O-N 3.44Å; W253-R255 PolarHBondContact O-N 3.29Å; W253-T256 PolarHBondContact O-N 3.26Å; W253-Q257 VanDerWaalsContact O-CB 3.25Å; W253-Q257 WeakPolarHBondContact O-CB 3.49Å; W253-Q257 PolarHBondContact O-N 2.88Å
254	N	77.1	Confident	82.5	Confident	95 Å²	95	81.4 Å²	81.4	51%	0.508	46%	0.46	S	S	.	.	H	α-helix	trans	-62.3	-41.9	178.8	-165.1	34.4	0	0	0	111.9	S250 V251 Q257 V258	S250-N254 VanDerWaalsContact O-CB 3.31Å; S250-N254 WeakPolarHBondContact O-CB 3.25Å; S250-N254 PolarHBondContact O-N 3Å; V251-N254 PolarHBondContact O-N 3.35Å; N254-Q257 PolarHBondContact O-N 3.5Å; N254-V258 WeakPolarHBondContact O-CG2 3.37Å; N254-V258 PolarHBondContact O-N 3.44Å
255	R	81.8	Confident	82.9	Confident	146 Å²	146	86.2 Å²	86.2	55%	0.551	49%	0.485	S	S	*	.	H	α-helix	trans	-60.3	-48.3	174.8	-80.8	-178.8	147.1	175.1	-4.7	112.2	V251 M252 W253 Q257 V258 V259	V251-R255 PolarHBondContact O-N 3.17Å; M252-R255 PolarHBondContact O-N 3.38Å; W253-R255 PolarHBondContact O-N 3.29Å; R255-Q257 VanDerWaalsContact C-N 3.33Å; R255-Q257 PolarHBondContact O-N 2.99Å; R255-V258 PolarHBondContact O-N 3.25Å; R255-V259 WeakPolarHBondContact O-CG2 3.24Å; R255-V259 PolarHBondContact O-N 3.44Å
256	T	85.5	Confident	83.5	Confident	100 Å²	100	85.1 Å²	85.1	61%	0.613	47%	0.474	S	S	*	.	H	α-helix	trans	-66.4	-37.3	179.2	-52.4	0	0	0	0	111.6	M252 W253 V259 G260	M252-T256 PolarHBondContact O-N 3.03Å; M252-T256 PolarHBondContact O-OG1 3.44Å; W253-T256 PolarHBondContact O-N 3.26Å; T256-V259 PolarHBondContact O-N 2.88Å; T256-G260 PolarHBondContact O-N 3.46Å
257	Q	87.6	Confident	84.3	Confident	97 Å²	97	86.3 Å²	86.3	45%	0.453	48%	0.482	S	S	.	.	H	α-helix	trans	-62.8	-45.9	176.8	-174.9	-177.5	-7.4	0	0	111.7	W253 N254 R255 G260 I261	W253-Q257 VanDerWaalsContact O-CB 3.25Å; W253-Q257 WeakPolarHBondContact O-CB 3.49Å; W253-Q257 PolarHBondContact O-N 2.88Å; N254-Q257 PolarHBondContact O-N 3.5Å; R255-Q257 VanDerWaalsContact C-N 3.33Å; R255-Q257 PolarHBondContact O-N 2.99Å; Q257-G260 PolarHBondContact O-N 2.87Å; Q257-I261 HydrophobicContact CG-CD1 4.06Å; Q257-I261 VanDerWaalsContact O-CG1 3.31Å; Q257-I261 WeakPolarHBondContact O-CG1 3.37Å; Q257-I261 PolarHBondContact O-N 2.86Å
258	V	90.1	Very high	85.3	Confident	71 Å²	71	87.5 Å²	87.5	43%	0.43	48%	0.481	S	S	.	.	H	α-helix	trans	-62.4	-45.5	178	171.8	0	0	0	0	111.2	N254 R255 G260 I261 L262	N254-V258 WeakPolarHBondContact O-CG2 3.37Å; N254-V258 PolarHBondContact O-N 3.44Å; R255-V258 PolarHBondContact O-N 3.25Å; V258-G260 VanDerWaalsContact C-N 3.31Å; V258-G260 PolarHBondContact O-N 3.3Å; V258-I261 PolarHBondContact O-N 2.95Å; V258-L262 HydrophobicContact CG1-CD1 4.17Å; V258-L262 WeakPolarHBondContact O-CG 3.44Å; V258-L262 PolarHBondContact O-N 2.93Å
259	V	89.8	Confident	86.2	Confident	90 Å²	90	87.2 Å²	87.2	55%	0.545	49%	0.492	S	S	.	.	H	α-helix	trans	-60.5	-44.1	175.6	175	0	0	0	0	110.5	R255 T256 I261 L262 V263	R255-V259 WeakPolarHBondContact O-CG2 3.24Å; R255-V259 PolarHBondContact O-N 3.44Å; T256-V259 PolarHBondContact O-N 2.88Å; V259-I261 PolarHBondContact O-N 2.84Å; V259-L262 PolarHBondContact O-N 3.42Å; V259-V263 HydrophobicContact CG1-CG2 4.27Å; V259-V263 WeakPolarHBondContact O-CB 3.44Å; V259-V263 VanDerWaalsContact O-CG2 3.28Å; V259-V263 WeakPolarHBondContact O-CG2 3.32Å; V259-V263 PolarHBondContact O-N 2.94Å
260	G	91.6	Very high	87.3	Confident	44 Å²	44	90.5 Å²	90.5	45%	0.454	50%	0.5	S	S	.	.	H	α-helix	trans	-59.5	-42.1	176.2	0	0	0	0	0	113.1	T256 Q257 V258 G264	T256-G260 PolarHBondContact O-N 3.46Å; Q257-G260 PolarHBondContact O-N 2.87Å; V258-G260 VanDerWaalsContact C-N 3.31Å; V258-G260 PolarHBondContact O-N 3.3Å; G260-G264 PolarHBondContact O-N 3.38Å
261	I	94	Very high	88.3	Confident	89 Å²	89	91.4 Å²	91.4	46%	0.456	50%	0.503	S	S	.	.	H	α-helix	trans	-63.8	-46.9	176.3	-69.9	166	0	0	0	110.7	Q257 V258 V259 G264 L265	Q257-I261 HydrophobicContact CG-CD1 4.06Å; Q257-I261 VanDerWaalsContact O-CG1 3.31Å; Q257-I261 WeakPolarHBondContact O-CG1 3.37Å; Q257-I261 PolarHBondContact O-N 2.86Å; V258-I261 PolarHBondContact O-N 2.95Å; V259-I261 PolarHBondContact O-N 2.84Å; I261-G264 PolarHBondContact O-N 3.12Å; I261-L265 HydrophobicContact CG2-CD1 3.94Å; I261-L265 HydrophobicContact CG2-CG 4.35Å; I261-L265 WeakPolarHBondContact O-CB 3.46Å; I261-L265 WeakPolarHBondContact O-CG 3.45Å; I261-L265 PolarHBondContact O-N 3.47Å
262	L	92.9	Very high	89.1	Confident	115 Å²	115	92 Å²	92	60%	0.602	51%	0.506	S	S	*	.	H	α-helix	trans	-63.5	-43.8	-179.9	-70.4	173.5	0	0	0	111.9	V258 V259 G266	V258-L262 HydrophobicContact CG1-CD1 4.17Å; V258-L262 WeakPolarHBondContact O-CG 3.44Å; V258-L262 PolarHBondContact O-N 2.93Å; V259-L262 PolarHBondContact O-N 3.42Å; L262-G266 PolarHBondContact O-N 2.88Å
263	V	93.4	Very high	89.9	Confident	84 Å²	84	89.3 Å²	89.3	51%	0.509	50%	0.499	S	S	.	.	H	α-helix	trans	-63.3	-45	175.3	172.5	0	0	0	0	110.5	V259 G266 I267	V259-V263 HydrophobicContact CG1-CG2 4.27Å; V259-V263 WeakPolarHBondContact O-CB 3.44Å; V259-V263 VanDerWaalsContact O-CG2 3.28Å; V259-V263 WeakPolarHBondContact O-CG2 3.32Å; V259-V263 PolarHBondContact O-N 2.94Å; V263-G266 PolarHBondContact O-N 3.46Å; V263-I267 HydrophobicContact CG1-CD1 3.92Å; V263-I267 WeakPolarHBondContact O-CG1 3.46Å; V263-I267 PolarHBondContact O-N 3.3Å
264	G	94.2	Very high	90.6	Very high	27 Å²	27	83.5 Å²	83.5	28%	0.278	49%	0.486	S	S	.	.	H	α-helix	trans	-60.4	-47.3	178.3	0	0	0	0	0	112.7	G260 I261 G266 I267 I268	G260-G264 PolarHBondContact O-N 3.38Å; I261-G264 PolarHBondContact O-N 3.12Å; G264-G266 VanDerWaalsContact C-N 3.32Å; G264-G266 PolarHBondContact O-N 2.84Å; G264-I267 PolarHBondContact O-N 3.42Å; G264-I268 VanDerWaalsContact O-CG1 3.28Å; G264-I268 WeakPolarHBondContact O-CG1 3.05Å; G264-I268 PolarHBondContact O-N 2.86Å
265	L	94.3	Very high	91.1	Very high	106 Å²	106	84.1 Å²	84.1	56%	0.555	49%	0.488	S	S	*	.	H	α-helix	trans	-62.4	-38.9	175.5	-70.8	176	0	0	0	111.9	I261 I268 A269	I261-L265 HydrophobicContact CG2-CD1 3.94Å; I261-L265 HydrophobicContact CG2-CG 4.35Å; I261-L265 WeakPolarHBondContact O-CB 3.46Å; I261-L265 WeakPolarHBondContact O-CG 3.45Å; I261-L265 PolarHBondContact O-N 3.47Å; L265-I268 PolarHBondContact O-N 3.21Å; L265-A269 WeakPolarHBondContact O-CB 3.38Å; L265-A269 PolarHBondContact O-N 3.44Å
266	G	93.6	Very high	91.2	Very high	33 Å²	33	82.4 Å²	82.4	34%	0.34	49%	0.489	S	S	.	.	H	α-helix	trans	-61.4	-44.7	174.8	0	0	0	0	0	113	L262 V263 G264 A269 L270	L262-G266 PolarHBondContact O-N 2.88Å; V263-G266 PolarHBondContact O-N 3.46Å; G264-G266 VanDerWaalsContact C-N 3.32Å; G264-G266 PolarHBondContact O-N 2.84Å; G266-A269 PolarHBondContact O-N 3.22Å; G266-L270 WeakPolarHBondContact O-CB 3.48Å; G266-L270 WeakPolarHBondContact O-CG 3.23Å; G266-L270 PolarHBondContact O-N 3.16Å
267	I	94.5	Very high	91.3	Very high	97 Å²	97	83.4 Å²	83.4	50%	0.497	49%	0.49	S	S	.	.	H	α-helix	trans	-64.5	-44.9	176.4	-66.5	168	0	0	0	110.6	V263 G264 A269 L270 V271	V263-I267 HydrophobicContact CG1-CD1 3.92Å; V263-I267 WeakPolarHBondContact O-CG1 3.46Å; V263-I267 PolarHBondContact O-N 3.3Å; G264-I267 PolarHBondContact O-N 3.42Å; I267-A269 VanDerWaalsContact C-N 3.34Å; I267-A269 PolarHBondContact O-N 3.11Å; I267-L270 PolarHBondContact O-N 3.02Å; I267-V271 HydrophobicContact CG2-CG2 4.35Å; I267-V271 WeakPolarHBondContact O-CG2 3.37Å; I267-V271 PolarHBondContact O-N 3.39Å
268	I	94.5	Very high	91.3	Very high	100 Å²	100	85.2 Å²	85.2	51%	0.513	50%	0.503	S	S	.	.	H	α-helix	trans	-59.3	-46.7	177.9	-69	165.8	0	0	0	110.2	G264 L265 L270 V271 T272	G264-I268 VanDerWaalsContact O-CG1 3.28Å; G264-I268 WeakPolarHBondContact O-CG1 3.05Å; G264-I268 PolarHBondContact O-N 2.86Å; L265-I268 PolarHBondContact O-N 3.21Å; I268-L270 PolarHBondContact O-N 3.11Å; I268-V271 PolarHBondContact O-N 2.78Å; I268-T272 HydrophobicContact CG2-CG2 3.93Å; I268-T272 VanDerWaalsContact O-CB 3.28Å; I268-T272 WeakPolarHBondContact O-CB 3.31Å; I268-T272 VanDerWaalsContact O-CG2 3.26Å; I268-T272 WeakPolarHBondContact O-CG2 3.32Å; I268-T272 PolarHBondContact O-N 3.1Å; I268-T272 PolarHBondContact O-OG1 3.07Å
269	A	92	Very high	91.1	Very high	55 Å²	55	83.6 Å²	83.6	46%	0.455	50%	0.496	S	S	.	.	H	α-helix	trans	-61.3	-42.6	177.7	0	0	0	0	0	112.1	L265 G266 I267 V271 S273	L265-A269 WeakPolarHBondContact O-CB 3.38Å; L265-A269 PolarHBondContact O-N 3.44Å; G266-A269 PolarHBondContact O-N 3.22Å; I267-A269 VanDerWaalsContact C-N 3.34Å; I267-A269 PolarHBondContact O-N 3.11Å; A269-V271 VanDerWaalsContact C-N 3.34Å; A269-V271 PolarHBondContact O-N 3.44Å; A269-S273 WeakPolarHBondContact O-CB 3.31Å; A269-S273 PolarHBondContact O-N 2.97Å
270	L	93.1	Very high	90.9	Very high	132 Å²	132	81.5 Å²	81.5	69%	0.691	49%	0.486	S	S	*	.	H	α-helix	trans	-63.2	-35.9	177.4	-83.9	167.7	0	0	0	113.3	G266 I267 I268 P274	G266-L270 WeakPolarHBondContact O-CB 3.48Å; G266-L270 WeakPolarHBondContact O-CG 3.23Å; G266-L270 PolarHBondContact O-N 3.16Å; I267-L270 PolarHBondContact O-N 3.02Å; I268-L270 PolarHBondContact O-N 3.11Å; L270-P274 WeakPolarHBondContact O-CD 3.36Å; L270-P274 VanDerWaalsContact O-CG 3.31Å; L270-P274 WeakPolarHBondContact O-CG 3.37Å
271	V	93.1	Very high	90.5	Very high	84 Å²	84	83 Å²	83	51%	0.509	49%	0.488	S	S	.	.	H	α-helix	trans	-85.1	-40.4	-179.2	176.2	0	0	0	0	111.8	I267 I268 A269 P274 L275	I267-V271 HydrophobicContact CG2-CG2 4.35Å; I267-V271 WeakPolarHBondContact O-CG2 3.37Å; I267-V271 PolarHBondContact O-N 3.39Å; I268-V271 PolarHBondContact O-N 2.78Å; A269-V271 VanDerWaalsContact C-N 3.34Å; A269-V271 PolarHBondContact O-N 3.44Å; V271-P274 WeakPolarHBondContact O-CD 3.25Å; V271-L275 HydrophobicContact CG1-CD1 4.26Å; V271-L275 WeakPolarHBondContact O-CG 3.49Å
272	T	89.2	Confident	89.9	Confident	60 Å²	60	82.8 Å²	82.8	37%	0.368	49%	0.493	S	S	.	.	H	α-helix	trans	-73.6	-33.7	-177.8	54.9	0	0	0	0	112.3	I268 L275 L276	I268-T272 HydrophobicContact CG2-CG2 3.93Å; I268-T272 VanDerWaalsContact O-CB 3.28Å; I268-T272 WeakPolarHBondContact O-CB 3.31Å; I268-T272 VanDerWaalsContact O-CG2 3.26Å; I268-T272 WeakPolarHBondContact O-CG2 3.32Å; I268-T272 PolarHBondContact O-N 3.1Å; I268-T272 PolarHBondContact O-OG1 3.07Å; T272-L275 PolarHBondContact O-N 3.38Å; T272-L276 WeakPolarHBondContact O-CB 3.48Å; T272-L276 VanDerWaalsContact O-CG 3.32Å; T272-L276 WeakPolarHBondContact O-CG 3.36Å; T272-L276 PolarHBondContact O-N 3.34Å
273	S	89.4	Confident	89.5	Confident	64 Å²	64	81.7 Å²	81.7	45%	0.448	49%	0.487	S	S	.	.	H	α-helix	trans	-59.6	-49	-179.2	179.9	0	0	0	0	113.1	A269 L275 L276 L277	A269-S273 WeakPolarHBondContact O-CB 3.31Å; A269-S273 PolarHBondContact O-N 2.97Å; S273-L275 PolarHBondContact O-N 3.09Å; S273-L276 PolarHBondContact O-N 2.83Å; S273-L277 VanDerWaalsContact O-CG 3.31Å; S273-L277 WeakPolarHBondContact O-CG 3.21Å; S273-L277 PolarHBondContact O-N 3.23Å
274	P	90.6	Very high	89	Confident	65 Å²	65	82.3 Å²	82.3	42%	0.422	49%	0.486	S	S	.	.	H	α-helix	trans	-61.3	-40	174	-24.4	33.5	0	0	0	114	L270 V271 L277 L278	L270-P274 WeakPolarHBondContact O-CD 3.36Å; L270-P274 VanDerWaalsContact O-CG 3.31Å; L270-P274 WeakPolarHBondContact O-CG 3.37Å; V271-P274 WeakPolarHBondContact O-CD 3.25Å; P274-L277 PolarHBondContact O-N 3.25Å; P274-L278 WeakPolarHBondContact O-CG 3.17Å; P274-L278 PolarHBondContact O-N 3.38Å
275	L	87.6	Confident	88.2	Confident	107 Å²	107	84.6 Å²	84.6	56%	0.56	50%	0.497	S	S	*	.	H	α-helix	trans	-66.7	-40.4	179.8	-67.6	173.7	0	0	0	111.8	V271 T272 S273 L278 A279	V271-L275 HydrophobicContact CG1-CD1 4.26Å; V271-L275 WeakPolarHBondContact O-CG 3.49Å; T272-L275 PolarHBondContact O-N 3.38Å; S273-L275 PolarHBondContact O-N 3.09Å; L275-L278 PolarHBondContact O-N 3.08Å; L275-A279 VanDerWaalsContact O-CB 3.3Å; L275-A279 WeakPolarHBondContact O-CB 3.43Å; L275-A279 PolarHBondContact O-N 2.99Å
276	L	84.8	Confident	87.4	Confident	110 Å²	110	83.7 Å²	83.7	58%	0.576	50%	0.499	S	S	*	.	H	α-helix	trans	-66.9	-38.5	174.9	-71.7	172.8	0	0	0	111.8	T272 S273 A279 S280	T272-L276 WeakPolarHBondContact O-CB 3.48Å; T272-L276 VanDerWaalsContact O-CG 3.32Å; T272-L276 WeakPolarHBondContact O-CG 3.36Å; T272-L276 PolarHBondContact O-N 3.34Å; S273-L276 PolarHBondContact O-N 2.83Å; L276-A279 PolarHBondContact O-N 2.98Å; L276-S280 VanDerWaalsContact O-CB 3.29Å; L276-S280 WeakPolarHBondContact O-CB 3.39Å; L276-S280 PolarHBondContact O-N 3.3Å
277	L	86.7	Confident	86.6	Confident	121 Å²	121	86.1 Å²	86.1	63%	0.634	51%	0.507	S	S	*	.	H	α-helix	trans	-63.9	-40.1	174.6	-72.6	172.7	0	0	0	112.1	S273 P274 S280 P281	S273-L277 VanDerWaalsContact O-CG 3.31Å; S273-L277 WeakPolarHBondContact O-CG 3.21Å; S273-L277 PolarHBondContact O-N 3.23Å; P274-L277 PolarHBondContact O-N 3.25Å; L277-S280 WeakPolarHBondContact O-CB 3.28Å; L277-P281 WeakPolarHBondContact O-CD 3.47Å
278	L	88.8	Confident	85.4	Confident	136 Å²	136	85 Å²	85	71%	0.712	51%	0.506	S	S	*	.	H	α-helix	trans	-70.4	-35.2	175.6	-71	171.7	0	0	0	112.8	P274 L275 P281	P274-L278 WeakPolarHBondContact O-CG 3.17Å; P274-L278 PolarHBondContact O-N 3.38Å; L275-L278 PolarHBondContact O-N 3.08Å; L278-P281 WeakPolarHBondContact O-CD 3.46Å
279	A	84.9	Confident	84.2	Confident	36 Å²	36	87.9 Å²	87.9	30%	0.298	52%	0.515	S	S	.	.	H	α-helix	trans	-79.7	-20	177.7	0	0	0	0	0	113.1	L275 L276 C282 I283	L275-A279 VanDerWaalsContact O-CB 3.3Å; L275-A279 WeakPolarHBondContact O-CB 3.43Å; L275-A279 PolarHBondContact O-N 2.99Å; L276-A279 PolarHBondContact O-N 2.98Å; A279-C282 WeakPolarHBondContact O-CB 3.44Å; A279-C282 PolarHBondContact O-N 3.46Å; A279-C282 VanDerWaalsContact O-N 3.1Å; A279-I283 HydrophobicContact CB-CD1 3.82Å; A279-I283 HydrophobicContact CB-CG1 4.39Å; A279-I283 VanDerWaalsContact O-CG1 3.31Å; A279-I283 WeakPolarHBondContact O-CG1 3.41Å; A279-I283 PolarHBondContact O-N 2.83Å
280	S	84.4	Confident	82.7	Confident	47 Å²	47	88.8 Å²	88.8	33%	0.329	52%	0.519	S	S	.	.	H	α-helix	trans	-53.5	-47.5	-175.8	179	0	0	0	0	113.8	L276 L277 C282 I283 I284	L276-S280 VanDerWaalsContact O-CB 3.29Å; L276-S280 WeakPolarHBondContact O-CB 3.39Å; L276-S280 PolarHBondContact O-N 3.3Å; L277-S280 WeakPolarHBondContact O-CB 3.28Å; S280-C282 VanDerWaalsContact C-N 3.32Å; S280-C282 PolarHBondContact O-N 3.14Å; S280-I283 PolarHBondContact O-N 3.26Å; S280-I284 WeakPolarHBondContact O-CB 3.12Å; S280-I284 WeakPolarHBondContact O-CD1 3.15Å; S280-I284 WeakPolarHBondContact O-CG1 3.23Å; S280-I284 PolarHBondContact O-N 3.1Å; S280-I284 WeakPolarHBondContact OG-CD1 3.46Å
281	P	83.8	Confident	81.1	Confident	76 Å²	76	86.3 Å²	86.3	49%	0.494	51%	0.511	S	S	.	.	H	α-helix	trans	-61	-38.9	177.1	-21.6	33.2	0	0	0	113	L277 L278 C285	L277-P281 WeakPolarHBondContact O-CD 3.47Å; L278-P281 WeakPolarHBondContact O-CD 3.46Å; P281-C285 VanDerWaalsContact O-CB 3.27Å; P281-C285 WeakPolarHBondContact O-CB 3.46Å; P281-C285 PolarHBondContact O-N 3.3Å; P281-C285 PolarHBondContact O-SG 3.37Å
282	C	82.7	Confident	79.4	Confident	83 Å²	83	92.2 Å²	92.2	56%	0.561	52%	0.524	S	S	*	.	H	α-helix	trans	-70.2	-43.9	178.5	-65.4	0	0	0	0	111.6	A279 S280 C285 C286	A279-C282 WeakPolarHBondContact O-CB 3.44Å; A279-C282 PolarHBondContact O-N 3.46Å; A279-C282 VanDerWaalsContact O-N 3.1Å; S280-C282 VanDerWaalsContact C-N 3.32Å; S280-C282 PolarHBondContact O-N 3.14Å; C282-C285 PolarHBondContact O-N 3.36Å; C282-C286 WeakPolarHBondContact O-CB 3.35Å; C282-C286 PolarHBondContact O-N 2.8Å; C282-C286 PolarHBondContact O-SG 3.49Å
283	I	82.8	Confident	77.9	Confident	92 Å²	92	91.4 Å²	91.4	47%	0.472	53%	0.528	S	S	.	.	H	α-helix	trans	-63.2	-47.6	177.3	-65.9	167	0	0	0	109.9	A279 S280 C285 C286 V287	A279-I283 HydrophobicContact CB-CD1 3.82Å; A279-I283 HydrophobicContact CB-CG1 4.39Å; A279-I283 VanDerWaalsContact O-CG1 3.31Å; A279-I283 WeakPolarHBondContact O-CG1 3.41Å; A279-I283 PolarHBondContact O-N 2.83Å; S280-I283 PolarHBondContact O-N 3.26Å; I283-C285 VanDerWaalsContact C-N 3.34Å; I283-C285 PolarHBondContact O-N 2.83Å; I283-C286 PolarHBondContact O-N 3.25Å; I283-V287 HydrophobicContact CG2-CG2 4.43Å; I283-V287 VanDerWaalsContact O-CG2 3.29Å; I283-V287 WeakPolarHBondContact O-CG2 3.29Å; I283-V287 PolarHBondContact O-N 3.24Å
284	I	83.1	Confident	76.2	Confident	97 Å²	97	96.1 Å²	96.1	50%	0.497	54%	0.54	S	S	.	.	H	α-helix	trans	-60.3	-43.6	176.8	-66.8	166.1	0	0	0	110.6	S280 C286 V287 C288	S280-I284 WeakPolarHBondContact O-CB 3.12Å; S280-I284 WeakPolarHBondContact O-CD1 3.15Å; S280-I284 WeakPolarHBondContact O-CG1 3.23Å; S280-I284 PolarHBondContact O-N 3.1Å; S280-I284 WeakPolarHBondContact OG-CD1 3.46Å; I284-C286 PolarHBondContact O-N 3.35Å; I284-V287 PolarHBondContact O-N 3.26Å; I284-C288 VanDerWaalsContact O-CB 3.31Å; I284-C288 WeakPolarHBondContact O-CB 3.35Å; I284-C288 PolarHBondContact O-N 3Å; I284-C288 PolarHBondContact O-SG 3.24Å
285	C	77.9	Confident	74.4	Confident	75 Å²	75	101.6 Å²	101.6	51%	0.507	56%	0.557	S	S	.	*	H	α-helix	trans	-64.9	-39.5	177.4	-74.9	0	0	0	0	113.1	P281 C282 I283 K289	P281-C285 VanDerWaalsContact O-CB 3.27Å; P281-C285 WeakPolarHBondContact O-CB 3.46Å; P281-C285 PolarHBondContact O-N 3.3Å; P281-C285 PolarHBondContact O-SG 3.37Å; C282-C285 PolarHBondContact O-N 3.36Å; I283-C285 VanDerWaalsContact C-N 3.34Å; I283-C285 PolarHBondContact O-N 2.83Å; C285-K289 WeakPolarHBondContact O-CG 3.28Å; C285-K289 PolarHBondContact O-N 3.24Å
286	C	78.4	Confident	72.7	Confident	87 Å²	87	105.1 Å²	105.1	59%	0.588	57%	0.568	S	S	*	*	H	α-helix	trans	-66.9	-42.1	176.4	-73.4	0	0	0	0	112	C282 I283 I284 K289 S290	C282-C286 WeakPolarHBondContact O-CB 3.35Å; C282-C286 PolarHBondContact O-N 2.8Å; C282-C286 PolarHBondContact O-SG 3.49Å; I283-C286 PolarHBondContact O-N 3.25Å; I284-C286 PolarHBondContact O-N 3.35Å; C286-K289 PolarHBondContact O-N 2.88Å; C286-S290 WeakPolarHBondContact O-CB 3.45Å; C286-S290 PolarHBondContact O-N 3.2Å
287	V	76.1	Confident	71.3	Confident	84 Å²	84	109.2 Å²	109.2	51%	0.509	58%	0.581	S	S	.	*	H	α-helix	trans	-64.7	-45.1	175.6	174	0	0	0	0	110.6	I283 I284 K289 S290 C291	I283-V287 HydrophobicContact CG2-CG2 4.43Å; I283-V287 VanDerWaalsContact O-CG2 3.29Å; I283-V287 WeakPolarHBondContact O-CG2 3.29Å; I283-V287 PolarHBondContact O-N 3.24Å; I284-V287 PolarHBondContact O-N 3.26Å; V287-K289 PolarHBondContact O-N 3.39Å; V287-S290 PolarHBondContact O-N 3Å; V287-S290 VanDerWaalsContact O-N 3.16Å; V287-C291 PolarHBondContact O-N 3.22Å; V287-C291 PolarHBondContact O-SG 3.12Å; V287-C291 VanDerWaalsContact O-SG 3.38Å
288	C	69.3	Low	69.5	Low	73 Å²	73	111.3 Å²	111.3	49%	0.493	59%	0.588	S	S	.	*	H	α-helix	trans	-61.9	-37.9	176.3	-74.2	0	0	0	0	113.4	I284 R292	I284-C288 VanDerWaalsContact O-CB 3.31Å; I284-C288 WeakPolarHBondContact O-CB 3.35Å; I284-C288 PolarHBondContact O-N 3Å; I284-C288 PolarHBondContact O-SG 3.24Å; C288-R292 PolarHBondContact O-N 2.86Å; C288-R292 VanDerWaalsContact O-N 3.1Å
289	K	68.6	Low	67.8	Low	161 Å²	161	111.6 Å²	111.6	70%	0.7	59%	0.59	S	S	*	*	H	α-helix	trans	-66.2	-40.6	172.8	-79.7	-178.6	178.5	176.2	0	112.1	C285 C286 V287 C291 R292 G293	C285-K289 WeakPolarHBondContact O-CG 3.28Å; C285-K289 PolarHBondContact O-N 3.24Å; C286-K289 PolarHBondContact O-N 2.88Å; V287-K289 PolarHBondContact O-N 3.39Å; K289-C291 VanDerWaalsContact C-N 3.35Å; K289-C291 PolarHBondContact O-N 3.37Å; K289-R292 PolarHBondContact O-N 3.03Å; K289-G293 PolarHBondContact O-N 3.25Å
290	S	61.5	Low	66.1	Low	75 Å²	75	114.7 Å²	114.7	52%	0.524	61%	0.607	S	S	.	*	H	α-helix	trans	-65	-37.5	177.1	-153.7	0	0	0	0	112	C286 V287 G293 K294	C286-S290 WeakPolarHBondContact O-CB 3.45Å; C286-S290 PolarHBondContact O-N 3.2Å; V287-S290 PolarHBondContact O-N 3Å; V287-S290 VanDerWaalsContact O-N 3.16Å; S290-G293 PolarHBondContact O-N 3.16Å; S290-K294 PolarHBondContact O-N 2.87Å; S290-K294 VanDerWaalsContact O-N 3.08Å
291	C	59.2	Low	64.5	Low	79 Å²	79	118.2 Å²	118.2	53%	0.534	63%	0.632	S	S	.	*	H	α-helix	trans	-65.3	-38.7	171.6	-68.1	0	0	0	0	113.1	V287 K289 K295	V287-C291 PolarHBondContact O-N 3.22Å; V287-C291 PolarHBondContact O-SG 3.12Å; V287-C291 VanDerWaalsContact O-SG 3.38Å; K289-C291 VanDerWaalsContact C-N 3.35Å; K289-C291 PolarHBondContact O-N 3.37Å; C291-K295 PolarHBondContact O-N 3.11Å
292	R	57.9	Low	62.6	Low	208 Å²	208	121 Å²	121	79%	0.785	65%	0.647	S	S	*	*	H	α-helix	trans	-67.6	-35	172.7	-81.9	-173.2	173.7	-138.6	0.4	112.6	C288 K289	C288-R292 PolarHBondContact O-N 2.86Å; C288-R292 VanDerWaalsContact O-N 3.1Å; K289-R292 PolarHBondContact O-N 3.03Å
293	G	56.6	Low	60.7	Low	43 Å²	43	126.7 Å²	126.7	44%	0.443	68%	0.68	S	S	.	*	H	α-helix	trans	-68.5	-36.6	177.2	0	0	0	0	0	113.8	K289 S290 K296	K289-G293 PolarHBondContact O-N 3.25Å; S290-G293 PolarHBondContact O-N 3.16Å; G293-K296 PolarHBondContact O-N 3.16Å
294	K	54.3	Low	59.6	Low	163 Å²	163	128.4 Å²	128.4	71%	0.709	69%	0.69	S	S	*	*	H	α-helix	trans	-69.9	-34.2	175.5	-75.6	-170.8	178.3	-177	0	113.2	S290 K296 K297	S290-K294 PolarHBondContact O-N 2.87Å; S290-K294 VanDerWaalsContact O-N 3.08Å; K294-K296 VanDerWaalsContact C-N 3.27Å; K294-K296 PolarHBondContact O-N 2.68Å; K294-K297 PolarHBondContact O-N 2.77Å
295	K	52.9	Low	58.3	Low	180 Å²	180	130.1 Å²	130.1	78%	0.783	70%	0.7	S	S	*	*	H	α-helix	trans	-64	-27.4	174.6	-80.3	-169.8	175.3	-174	0	113.6	C291	C291-K295 PolarHBondContact O-N 3.11Å
296	K	52.8	Low	57.3	Low	182 Å²	182	133.1 Å²	133.1	79%	0.791	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-11.3	178.4	-91.3	-170.9	173.3	-172.4	0	115.3	G293 K294	G293-K296 PolarHBondContact O-N 3.16Å; K294-K296 VanDerWaalsContact C-N 3.27Å; K294-K296 PolarHBondContact O-N 2.68Å
297	K	54	Low	56	Low	195 Å²	195	135.8 Å²	135.8	85%	0.848	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	1.6	-178.2	-86.4	-171	174.9	-174.5	0	114.3	K294	K294-K297 PolarHBondContact O-N 2.77Å
298	H	49.8	Very low	54.8	Low	166 Å²	166	139.1 Å²	139.1	77%	0.769	73%	0.731	S	S	*	*			trans	-119.2	32.9	-175.6	-147.8	-61.8	0	0	0	112.8
299	D	52.4	Low	53.8	Low	141 Å²	141	143.5 Å²	143.5	75%	0.754	75%	0.747	S	S	*	*			trans	-90.6	117.4	159.9	-85.6	-35.7	0	0	0	108.2
300	P	49.8	Very low	52.7	Low	101 Å²	101	142.2 Å²	142.2	66%	0.656	75%	0.751	S	S	*	*			trans	-76.9	127.2	177	30	-29.7	0	0	0	110.2	T302	P300-T302 PolarHBondContact O-N 3.4Å
301	S	50.2	Low	52.1	Low	121 Å²	121	147.4 Å²	147.4	85%	0.846	77%	0.768	S	S	*	*			trans	-56.3	107.8	166.4	-32.7	0	0	0	0	109
302	T	44.8	Very low	51.5	Low	134 Å²	134	153.1 Å²	153.1	82%	0.822	79%	0.788	S	S	*	*			trans	-88.8	119.4	171.5	-48.9	0	0	0	0	107.8	P300	P300-T302 PolarHBondContact O-N 3.4Å
303	T	42.1	Very low	50.9	Low	203 Å²	203	148.1 Å²	148.1	100%	1.245	79%	0.788	S	S	*	*			trans	-98.5	0	162.2	-27.5	0	0	0	0	107

Retrieved 303 of 303 residues in 235.2 ms (Link to these results)

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